update data

{
  "date": "2025-12-20T04:01:18.357Z",
  "molecules": 23981,
  "errors": 44,
  "nogood": 33,
  "notfound": 2264,
  "dup": 525
}

Author: cheminfo-bot

public/data.json

@@ -4563,7 +4563,7 @@ gJ@l\PiRHTQNWYbp@@	Tungsten dichloride dioxide
 gGQJJEJXbqMbGDc}T`@	Tungsten(VI) oxytetrabromide
 gGQJJEJQBbMDFHc}T`@	Tungsten(VI) oxytetrachloride
 gGQJJEJRBdMHFPc}T`@	Tungsten oxytetrafluoride
-eDbHz@AE@	Vanadium nitride
+eFbHzHx@	Vanadium nitride
 dknD@IADfvYWtvj``@@@	Phenibut
 eMCBR`aBHu@	Tantalum(IV) sulfide
 gB@BAIRpUak@@@	Tantalum trialuminide
@@ -17455,6 +17455,7 @@ feg@H@@HUEN^srJIQJIQKQQSJhdXxkQmThU@CPDT@HLP	Xerocomic acid
 fi{Ap@@HUEKQyEDheDhehhlbbQcluzuRaT@LAE@@@	Atromentic acid
 fi{Ap@@HUEKQyEDheDhehhlbbQcluzuRaT@LAE@BCD	Atromentic acid
 few@H@@HUxKQsrJIQJIQKQQUIKDX{HXuzuRaTC@AEQ@@@	Xerocomorubin
+d^D@bFhDxV{nGiy^wcz~_oxA`TGAHZEaAHQDqBRdYNPTeESTMKQt}@rLSLplkFslGIq\wCr|_OpB`dKBHjIbxaJRTmHrlgKrBhiJrbjjZnhZfekZNkiz~`ZFQlXfif[fEiYVucZv]oXNcd{NKjx@ThARPEK@TbARhEI`TnARDEJPTeARtEHpTkAR\EKpT`aRbEIHTlaRJEJhsFcLzLpXsIcLVLsXsCcLnLqxtOcP@G`GPGpGHGhGXGxGDGdGTGtGLGlG\G|GBGbGRGrGJGjMZMzMFMfMVMvMNMnM^I~IAFaFQFqFIFiFYFyFEFeFUFuFMFmF]F}FCFcFSFsFKFkF[F{FGFgFWFwFOFoF_FF@f`fPfpfHfhfXfxfDfdfTftfLflf\f|fBfbfRfrfJfjfZfzfFfffVfvfNfnf^f~fAfafQfqfIfifYfyfEfefUfufMfmf]f}fCfcfSfsfKfkf[i{iGigiWiwiOioi_ii@Y`YPYpYHYhYXY@@@@	HPA-23
 gGP`@dfUjp@	Methyl propiolate
 gNp`@dfUZn@@	Ethyl propiolate
 ejYPAH@AJfaimkhPICHiEHhhhblXdicBeMEEeOMKGHdblRZjjjYjjZfi``JhxPVDHRd|bTJP@	Cortobenzolone
@@ -21598,7 +21599,7 @@ dazD@NADfvVjh@@	3-Methyl-GABA
 f`ipB@AJ\CDRYVy{VgAJ]z@HZZhh@@	VU6067416
 dayD@BxDR[mZj`@	2,4-Diaminobutyric acid
 f`qQ@@NFAdTTRbcRRXKdhBHZjR@@	4-HO-NALT
-eDbH^`AE@	Plutonium nitride
+eFbH^hx@	Plutonium nitride
 eg`RBL@IK@acGDc`H`bPvdDfY}Yf{yWmYccpKjZB@jfZhHHia@@@	ADX-71441
 ffcp`@JZ\AFQQJJQJMRJUIVgQKUjfijj@B`@@	U-93631
 diFD@FADfumjjp@	Γ-Acetylenic GABA
@@ -21610,7 +21611,7 @@ fbca`@G@igIEDedeHdecbgAF\zHTtDAUTuTUXdcIL@@	Crinine
 fmi@@JLdXhLdTRaTrTRRVbRRIPTk^cdZzeej`P`HLj@@@	KRM-II-81
 fj}AP@@\dDnQQQJJKPqY[Ldhr\m@qDPPE@@@	6-Methylapigenin
 fbuH`@OAcdELdTtRRrtTROIQSPPQTAA@@@	Ormetoprim
-eDbXncZ`@	Neptunium nitride
+eFbHnhx@	Neptunium nitride
 eFbH~hx@	Americium nitride
 fewaC@DsAHHdLRFQRFIKJIJYQJUHTg^cdmZh@H@JjjhJ@@	FEM-1689
 echTD@@Hl`KDfUmiYW]]UhXdL|RBbZzVv`@jjjjH@@H`pxTdLP@	KNT-127
@@ -21785,6 +21786,7 @@ gC`B@mRPTaiBOT@@	Thorium trifluoride
 gC`B@mRHTQhbOT@@	Thorium trichloride
 ehZVD@@DALbf`PKLbbbbbbTRRlZbRrbRXdBrbRfV~AZi`jXJJ@BjjH`@@	Dalpiciclib
 elZRLN@MGMgkJk`H`RPddEI@F@a`DXCHhhdiMULhdleDeCLiFNLbemhBBjf`@h@Ijh@@Ac@E@aPDT@	Donafenib
+eodPND@CKLiemc`HbjPrJJIKJJQIIQSPyKEc`IjIHkj@`hJ`jhjjhJhdSbbQRzP@	Henagliflozin
 efVPL@@@DLbaHQDQDaDQDaDQHaHaIQDQDQDRsqjj``bjjjjjjj@@@	Octadecyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate
 dmDAsDpjxYTMbHah`Eke{@iHGIEYV@@	Cobalt(II) perchlorate
 fhb@{FDXIS`iJtZsoAAlPbFQ@EirnpJRArP@@AVU`@@	Cobalt(II) perchlorate
@@ -23970,4 +23972,10 @@ e`ZVDD@BJFOJcai`ICzPrJJJIZIPqQQJJJUMLBJZYKE[UMWOPDQUUMUTuRqTrDbl`@	Onradivir
 fnsQ@@DFAdTTTTrTRfbrnoNsUkUAPUAT@P`dD`@	Β-U10
 ehTTB@@CJ`DColbbTrTJTVRdRbfQfVDdvnZ`@jjjkB`bhHHh@@	Etripamil
 fhf@Z`lDhpTeZl{pP_dOq@QpHLD@vFtygJ{W^xOXAiHGI@yHmKRt@@	Europium(III) sulfate
+fif@V`lDhpTeZl{pXirVk^cA~PDAG@`pPCX[Sf\km]{`}`Fd`\dCd`@@@BtmKP@@	Europium(III) sulfate
 fbmQB@LDTBPRVVYY^WXIrXyij`P@`H@@@	HQ-355
+fhi`b@GDdCDRYeWVuXKpXHHjjh`@@	2C-B-3PIP
+fegab@GDeTFIdTTRRrTrTJbbRXKp^s``bjjjBBB@@@	2C-B-3PIP-NBOMe
+fi{ab@GDdTFHdsJnmklrkA^Bt\DDUUUAAA@@@	2C-B-3PIP-POMe
+dg~H`Mh@aJYW]gJxZB@jj@@	SDMA (drug)
+dk^H`Mh@aJYW]lkahHBj`@@	SDA (drug)

public/idcode.txt

@@ -4563,7 +4563,7 @@ Tungsten dichloride dioxide	[O-2].[O-2].[Cl-].[Cl-].[W]
 Tungsten(VI) oxytetrabromide	O=[W](Br)(Br)(Br)Br
 Tungsten(VI) oxytetrachloride	O=[W](Cl)(Cl)(Cl)Cl
 Tungsten oxytetrafluoride	O=[W](F)(F)(F)F
-Vanadium nitride	[N].[V]
+Vanadium nitride	N#[V]
 Phenibut	O=C(O)CC(c1ccccc1)CN
 Tantalum(IV) sulfide	S=[Ta]=S
 Tantalum trialuminide	[Al].[Al].[Al].[Ta]
@@ -17455,6 +17455,7 @@ Xerocomic acid	OC(=O)C(=C1\OC(=O)C(=C1O)C1=CC=C(O)C(O)=C1)\C1=CC=C(O)C=C1
 Atromentic acid	c1cc(O)ccc1C(=C(O)2)C(=O)OC2=C(C(O)=O)c3ccc(O)cc3
 Atromentic acid	C1=CC(=CC=C1C2=C(/C(=C(/C3=CC=C(C=C3)O)\C(=O)O)/OC2=O)O)O
 Xerocomorubin	c1cc(O)ccc1C(=C(O)2)C(=O)OC2=C3C(=O)OC4=C3C=C(O)C(O)=C4
+HPA-23	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[W+6].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]
 Methyl propiolate	COC(=O)C#C
 Ethyl propiolate	CCOC(=O)C#C
 Cortobenzolone	C[C@]12C[C@@H](C3([C@H]([C@@H]1C[C@H]([C@@]2(C(=O)COC(=O)C4=CC=CC=C4O)O)O)CCC5=CC(=O)C=C[C@@]53C)F)O
@@ -21598,7 +21599,7 @@ Corymine	CC=C1CN2CCC34C2(C5CC1C3(C(O5)O)C(=O)OC)N(C6=CC=CC=C46)C
 VU6067416	Brc1cc2c(n[NH]c2cc1)C=1CNCCC=1
 2,4-Diaminobutyric acid	C(CN)C(C(=O)O)N
 4-HO-NALT	C=CCNCCC1=CNC2=C1C(=CC=C2)O
-Plutonium nitride	[N].[Pu]
+Plutonium nitride	N#[Pu]
 ADX-71441	CC(=O)NC1=C(C=CC(=C1)N2C(=O)N(C(=O)C(=N2)OC)CC3=CC(=C(C=C3)Cl)F)F
 U-93631	CC1(C2=C(N=CN2C3=CC=CC=C3N1)C(=O)OC(C)(C)C)C
 Γ-Acetylenic GABA	C#CC(CCC(=O)O)N
@@ -21610,7 +21611,7 @@ Crinine	C1CN2CC3=CC4=C(C=C3[C@]15[C@H]2C[C@H](C=C5)O)OCO4
 KRM-II-81	C#CC1=CC2=C(C=C1)N3C=NC(=C3CN=C2C4=CC=CC=N4)C5=CN=CO5
 6-Methylapigenin	CC1=C(C2=C(C=C1O)OC(=CC2=O)C3=CC=C(C=C3)O)O
 Ormetoprim	CC1=CC(=C(C=C1CC2=CN=C(N=C2N)N)OC)OC
-Neptunium nitride	[Np+3].[N-3]
+Neptunium nitride	[Np]#N
 Americium nitride	[Am]#N
 FEM-1689	FC(F)(F)c1ccc(cc1)c1cc2c(cc1)C1CC2N(CC1)CCCO
 KNT-127	CN1CC[C@]23CC4=NC5=CC=CC=C5C=C4C[C@]2([C@H]1CC6=C3C=C(C=C6)O)O
@@ -21785,6 +21786,7 @@ Thorium trifluoride	F[Th](F)F
 Thorium trichloride	Cl[Th](Cl)Cl
 Dalpiciclib	CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)C4CCNCC4)C5CCCC5)C(=O)C
 Donafenib	[2H]C([2H])([2H])NC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F
+Henagliflozin	CCOC1=C(C=C(C=C1)CC2=C(C=CC(=C2)[C@]34[C@@H]([C@H]([C@@H]([C@](O3)(CO4)CO)O)O)O)Cl)F
 Octadecyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate	C(CC(OCCCCCCCCCCCCCCCCCC)=O)C1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1
 Cobalt(II) perchlorate	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+2]
 Cobalt(II) perchlorate	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+2].O.O.O.O.O.O
@@ -23970,4 +23972,10 @@ Onradivir	C1CC2CCC1[C@@H]([C@H]2NC3=NC(=NC(=C3F)C4CC4)C5=C6C=C(C=NC6=NN5)F)C(=O)
 Β-U10	CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)C2=CC3=CC=CC=C3C=C2
 Etripamil	COC(=O)C1=CC(CCN(C)CCC[C@](C#N)(C(C)C)C2=CC=C(OC)C(OC)=C2)=CC=C1
 Europium(III) sulfate	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Eu+3].[Eu+3]
+Europium(III) sulfate	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Eu+3].[Eu+3]
 HQ-355	CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CF
+2C-B-3PIP	COC1=CC(=C(C=C1C2CCCNC2)OC)Br
+2C-B-3PIP-NBOMe	COc1cc(Br)c(cc1C1CCCN(C1)Cc1ccccc1OC)OC
+2C-B-3PIP-POMe	COC1=CC=CC=C1C2CCC(CN2)C3=CC(=C(C=C3OC)Br)OC
+SDMA (drug)	CC(CC1=CC2=C(C=C1)OCS2)NC
+SDA (drug)	CC(CC1=CC2=C(C=C1)OCS2)N

public/smiles.txt

@@ -3913,5 +3913,6 @@
 {"date":"2025-12-16T04:04:15.976Z","molecules":23968,"errors":43,"nogood":32,"notfound":2264,"dup":525},
 {"date":"2025-12-17T04:02:00.975Z","molecules":23969,"errors":44,"nogood":33,"notfound":2264,"dup":525},
 {"date":"2025-12-18T04:03:20.849Z","molecules":23969,"errors":44,"nogood":33,"notfound":2264,"dup":525},
-{"date":"2025-12-19T04:03:21.323Z","molecules":23973,"errors":44,"nogood":33,"notfound":2265,"dup":525}
+{"date":"2025-12-19T04:03:21.323Z","molecules":23973,"errors":44,"nogood":33,"notfound":2265,"dup":525},
+{"date":"2025-12-20T04:01:18.357Z","molecules":23981,"errors":44,"nogood":33,"notfound":2264,"dup":525}
 ]