Dataset Viewer
image
imagewidth (px) 165
3.73k
| smiles
stringlengths 6
185
|
---|---|
C\1=C/C(=N\Br)/C(=C/C1=N/Br)Cl
|
|
CSP1(=S)SP(=S)(S1)SC
|
|
CCCCCCCCCCCCCCCCSCCCCPCOO
|
|
C[C@@H]1CC[C@H]2[C@@]3(CO3)C(O[C@H]4[C@@]25[C@H]1CC[C@](O4)(OO5)C)O
|
|
C1C[C@H]([C@@H](C1)O)CCCO
|
|
C1=CC=NC(=C1)N2C=CSN2
|
|
CCSN1CCN(CC1)SCC
|
|
B(C(C(O)F)N(CCO)CCO)(F)F
|
|
C1(=C(C(=O)SC1=O)Cl)Cl
|
|
CSC[C@@H](C(=O)O)N
|
|
[2H]C1=CC(=C(C=C1C([2H])([2H])[2H])[2H])C
|
|
CN(C)C1=CC1=NC#N
|
|
CC(C)(C#N)[C@@H]1CC=C(C1)OS(=O)(=O)C(F)(F)F
|
|
CC(=C[C@@H]1[C@@H](C1(C)C)C(=O)O)C
|
|
CC(/C=C/C#N)C=O
|
|
C[C@@H](/C=C/[C@@]1([C@](CCCC1(C)C)(C)O)O)O
|
|
C(=NSN=C=O)=O
|
|
C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O
|
|
CO/C(=C/C1=CC=CC=C1)/C#N
|
|
CSC(=S)C(SC)(SC)SC
|
|
B(Cl)(/C=C/Cl)/C=C/Cl
|
|
C1=C(NC=N1)C[C@@H](C(=O)O)N
|
|
C[C@@H]1CCCC1C
|
|
C1=C(SC(=O)N1)CCl
|
|
C(=NC(C(F)(F)Br)(F)Br)=O
|
|
B1BBB1
|
|
CC(C)(C)OC(=O)NNC[C@@H]1CCOC1=O
|
|
B(=C(C)CC)OC#N
|
|
B(CC)(CC)OS(=O)(=O)OB(CC)CC
|
|
C1CCC(CC1)N=P(C(Cl)(Cl)Cl)(C(Cl)(Cl)Cl)Cl
|
|
CC(C)(C)S/C(=C(\Cl)/Br)/Cl
|
|
C[C@@H]1CCC[C@H](C1C)C
|
|
CCO[C@@H]1C[C@H]2[C@H]3CC[C@H](C3)[C@H]2CO1
|
|
CCCCOC(=O)[C@@H]([C@H](C(=O)OCCCC)O)O
|
|
CC(C)(C#N)N=S(C1=CC=C(C=C1)Cl)Cl
|
|
CP(C)P(=O)(C)C
|
|
[B](C(C)O)C(OCC)OCC
|
|
CCC(=O)C[C@H](C)C(C)C
|
|
[C@H]([C@@H]([C@@H](C(=O)O)O)O)([C@H](C(=O)O)O)O
|
|
C([C@@H]([C@H](C(=O)CO)O)O)O
|
|
CO[C@H]1C[C@H]2[C@H]3CC[C@H](C3)[C@H]2CO1
|
|
C1CN[C@@H]1C(=O)O
|
|
C1=CN=C(N=C1)P(=O)(O)O
|
|
C[C@@H]([C@@H](CC1=CC=CC=C1)Br)O
|
|
C1(=O)N=NC(=O)S1
|
|
C=CN1C=CN=N1
|
|
C[C@@]12CC[C@@H]3[C@@](C1)(CC[C@H]2Br)[C@H](CC3(C)C)OC
|
|
C[C@@H]1CC[C@@]2([C@@H]3[C@@H]1CC[C@@]2(CC3(C)C)C)O
|
|
CC1(CON(O1)C(=O)N(C)C)C
|
|
C[C@@]1(CCC2C1(CCC3C2CCC4=C3CCC(=O)C4)C)O
|
|
C(=N\OP(=O)(O)O)(\N)/OP(=O)(O)OP(=O)(O)O
|
|
C(=NP(=S)(N=C=S)N=C=S)=S
|
|
CN(C)C(=O)SSC(=O)N(C)C
|
|
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O
|
|
C1=C(C=NN1C(=O)NC(=O)CCl)Br
|
|
CC(C1=PC=PC=P1)O
|
|
CC(C)N(C(=O)F)SN(C(C)C)C(=O)F
|
|
CCOC(=O)[C@H](CC(=O)C1=CC=CC=C1)N[C@@H](C)C(=O)OC
|
|
CC(C)[C@H]1CC[C@@]2([C@@H]3[C@H]1[C@H](C24CO4)[C@@H]([C@@H]3O)O)C
|
|
COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N
|
|
CC1=C(C1=O)C
|
|
C(OSC(=O)SO)F
|
|
CCP1C(=C)[P-]P(C(=C)[P-]1)CC
|
|
CN(C)P(=NC(=O)C(Br)(Br)Br)(N(C)C)N(C)C
|
|
COC(=O)/C(=N\Cl)/N(Cl)Cl
|
|
C(=O)=S(F)P(P)PP
|
|
CC1(COCN1SSN2COCC2(C)C)C
|
|
C1=C(SSSSS1)N
|
|
[2H]C([2H])([2H])OCOC
|
|
CCN1C(C(SCC1=O)Cl)Cl
|
|
C1=C2C(=CC(=NC#N)S2)SC1=NC#N
|
|
C(=N/OBr)\Cl
|
|
C1C(=NNC(=O)N)CSS1
|
|
CC12CC[C@H]3C([C@@H]1CC[C@H]2O)CCC4=C3C=CC(=C4)O
|
|
[2H]C([2H])([2H])C(C(=O)O)(C([2H])([2H])Cl)O
|
|
[2H]/C(=C(\C)/O)/C(=O)C
|
|
[SiH]#[Zr]
|
|
CC1=CCC(C[C@@H]1O)C(C)(C)O
|
|
CCOC(C)(OCC)OP(=O)(CC)CF
|
|
C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C
|
|
C1=NNC2=C1SSSSS2
|
|
CC(=O)O[C@H]1CCCN2[C@@H]1C3=C(CC2)C4=CC=CC=C4N3
|
|
CCC/C=C(/SCC#C)\SOS(=O)Cl
|
|
C(F)(F)(S(=O)S(=O)C(F)(F)Br)Cl
|
|
O=[Sn]1O[Sn]2(O1)O[Sn](=O)O2
|
|
CC(C)[C@@H]1C[C@@H]([C@]2(CCCC(=C)[C@@H]2[C@H]1O)C)O
|
|
C1([Si]2=[Si]1C2(F)F)(F)F
|
|
C/C=C(\C)/C/C(=N\Cl)/OC
|
|
C(C(N)P(=O)(O)O)S(=O)(=O)O
|
|
COS(#N)=P[P+]#P
|
|
CP(=S)(CC1=CC=CC=C1)P(=S)(C)CC2=CC=CC=C2
|
|
CC1([C@@H]([C@H](CN1C)C(=O)OC)C(=O)OC)C(=O)OC
|
|
C[C@H]1C[C@H]2CC3=CC=CC=C3N2N1
|
|
C[S-](#C)OOOOO
|
|
C[C@]12CC[C@H](C1(C)C)C[C@@H]2S(=O)C(=C)C3=CCCCC3
|
|
CC1=C(CCO1)OC(=O)Cl
|
|
CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C1)O
|
|
C=P(C1CC1)(C2CC2)C3=CC=CC=C3
|
|
O=S(I(Cl)Br)I(Cl)Br
|
|
C(N(COS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O
|
End of preview. Expand
in Data Studio
README.md exists but content is empty.
- Downloads last month
- 59