SMILES stringlengths 11 220 | Source stringclasses 16
values |
|---|---|
C1=Cc2[nH]c3c4c(c5c(c3c2C1)=CCC=5)C=C(c1scc2cc[se]c12)C4 | tartarus_pce_pcdtbt |
C1=c2c(c3c4[se]ccc4c4nsnc4c3c3[se]c(-c4scc5cc[nH]c45)cc23)=CC1 | tartarus_pce_pcdtbt |
c1ccc2c(c1)ccc1c3nsnc3c3c4sccc4c4nsnc4c3c21 | tartarus_pce_pcdtbt |
C1=CCC(c2cc3c4c(c5ccc6cscc6c5c3c3c2=CCC=3)=CCC=4)=C1 | tartarus_pce_pcdtbt |
C1=Cc2csc(C3=Cc4cnc5c(c4C3)c3c(c4cc[se]c45)=C[SiH2]C=3)c2C1 | tartarus_pce_pcdtbt |
c1cc2csc(-c3ccc4c(c3)[nH]c3cc5ccc6cscc6c5cc34)c2[se]1 | tartarus_pce_pcdtbt |
C1=Cc2cnc3c(c2C1)c1c(c2cc(-c4scc5ccsc45)[se]c23)=C[SiH2]C=1 | tartarus_pce_pcdtbt |
C1=C(c2ccc[se]2)[SiH2]c2c1c1cocc1c1c2[nH]c2ccccc21 | tartarus_pce_pcdtbt |
c1ccc2c(c1)c1cc[se]c1c1[se]c3cc(-c4scc5nccnc45)c4cocc4c3c21 | tartarus_pce_pcdtbt |
C1=Cc2c(csc2C2=Cc3ncc4c5[se]ccc5c5nsnc5c4c3C2)C1 | tartarus_pce_pcdtbt |
C1=C(c2cccs2)Cc2c1c1c[nH]cc1c1c2sc2ccc3ccccc3c21 | tartarus_pce_pcdtbt |
C1=Cc2[se]c3c4c(c5nsnc5c3c2[SiH2]1)C=C(c1cncc2nsnc12)[SiH2]4 | tartarus_pce_pcdtbt |
C1=c2c(-c3scc4ccoc34)cc3[nH]c4c([se]c5ccc6cscc6c54)c3c2=C[SiH2]1 | tartarus_pce_pcdtbt |
C1=c2c(c3c(ncc4cc(-c5nccc6nsnc56)[se]c43)c3cnccc23)=CC1 | tartarus_pce_pcdtbt |
c1cc2[nH]c3c4[se]ccc4c4c[nH]cc4c3c2cn1 | tartarus_pce_pcdtbt |
c1csc(-c2ccc3c(c2)c2cocc2c2c4c5cocc5ccc4c4ccccc4c32)c1 | tartarus_pce_pcdtbt |
c1cncc(-c2cc3cc4ccc5ccc6cscc6c5c4cc3c3cocc23)c1 | tartarus_pce_pcdtbt |
C1=c2c(c3c(cnc4ccc5cocc5c43)c3[se]c(-c4ccc[nH]4)cc23)=CC1 | tartarus_pce_pcdtbt |
c1ccc2c(c1)ccc1c3nsnc3c3c(oc4ccc5ccccc5c43)c21 | tartarus_pce_pcdtbt |
C1=c2c(c3c(cnc4ccc5cscc5c43)c3cnc(-c4scc5cc[se]c45)cc23)=CC1 | tartarus_pce_pcdtbt |
C1=c2c(c3c(ncc4cc(-c5scc6ccoc56)[se]c43)c3ccccc23)=C[SiH2]1 | tartarus_pce_pcdtbt |
C1=Cc2csc(C3=Cc4c(c5[se]c6ccc7nsnc7c6c5c5c4=C[SiH2]C=5)C3)c2C1 | tartarus_pce_pcdtbt |
C1=Cc2[nH]c3c([se]c4cc(-c5ccc[se]5)ccc43)c2C1 | tartarus_pce_pcdtbt |
C1=Cc2[nH]c3c([se]c4cc(-c5scc6nccnc56)c5c(c43)=CCC=5)c2C1 | tartarus_pce_pcdtbt |
C1=C(c2cccc3cscc23)Cc2c1ncc1c3[se]ccc3c3cscc3c21 | tartarus_pce_pcdtbt |
C1=c2c(c3cc[se]c3c3cc4ncc(-c5nccc6nsnc56)cc4cc23)=CC1 | tartarus_pce_pcdtbt |
c1csc(-c2cc3ccc4c(c3cn2)c2ccccc2c2ccc3cscc3c24)c1 | tartarus_pce_pcdtbt |
C1=C(c2scc3cc[se]c23)[SiH2]c2c1oc1c2cnc2ccncc21 | tartarus_pce_pcdtbt |
c1c[se]c(-c2cnc3c(c2)[nH]c2c4[se]ccc4c4cscc4c32)c1 | tartarus_pce_pcdtbt |
c1coc(-c2ccc(-c3sc(-c4scc5nccnc45)c4[nH]ccc34)c3nsnc23)c1 | tartarus_pce_pcdtbt |
C1=Cc2c(c3ncc4ccc5nsnc5c4c3c3cscc23)[SiH2]1 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cnc4c(cnc5c4ccc4cc[se]c45)c3)c2C1 | tartarus_pce_pcdtbt |
C1=Cc2c(csc2-c2cc3c4c(c5c6[nH]ccc6c6c(c5c3[se]2)=C[SiH2]C=6)=CCC=4)[SiH2]1 | tartarus_pce_pcdtbt |
C1=Cc2[se]c3cc(-c4ccccc4)c4ccccc4c3c2C1 | tartarus_pce_pcdtbt |
c1cc2c3c[nH]cc3c3c(ccc4cc(-c5scc6ccoc56)[se]c43)c2[nH]1 | tartarus_pce_pcdtbt |
c1cc2csc(-c3ccc4c(c3)[se]c3c4ccc4ccc5cscc5c43)c2s1 | tartarus_pce_pcdtbt |
c1ncc2nsnc2c1-c1cc2cnc3c4c5c[nH]cc5ccc4c4cocc4c3c2[se]1 | tartarus_pce_pcdtbt |
C1=Cc2ncc3c([se]c4cc(-c5cccc6nsnc56)c5c(c43)=CCC=5)c2C1 | tartarus_pce_pcdtbt |
C1=Cc2c(-c3scc4ccoc34)sc(-c3sc(-c4scc5nccnc45)c4ccsc34)c2[SiH2]1 | tartarus_pce_pcdtbt |
C1=C(c2ccc[se]2)Cc2c1c1ccccc1c1c3sccc3c3cscc3c21 | tartarus_pce_pcdtbt |
C1=Cc2c(csc2-c2cc3c4cocc4c4c5ncccc5[nH]c4c3[se]2)[SiH2]1 | tartarus_pce_pcdtbt |
c1coc(-c2ccc(-c3sc(-c4scc5nccnc45)c4cc[nH]c34)c3nsnc23)c1 | tartarus_pce_pcdtbt |
c1cc2csc(-c3cc4cnc5c(cnc6ccc7cocc7c65)c4c4cscc34)c2[se]1 | tartarus_pce_pcdtbt |
c1cc(-c2cc3ccc4c(oc5ccc6cscc6c54)c3c3nsnc23)c2nsnc2c1 | tartarus_pce_pcdtbt |
c1cc2csc(-c3cc4[se]c5c(sc6ccc7c[nH]cc7c65)c4c4c[nH]cc34)c2o1 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4ccc5c6[nH]ccc6[se]c5c4cn3)c2C1 | tartarus_pce_pcdtbt |
c1ccc(-c2cc3cc4ncc5ccc6ccccc6c5c4cc3s2)nc1 | tartarus_pce_pcdtbt |
c1cncc(-c2cc3c4nsnc4c4c5occc5c5cscc5c4c3c3cscc23)c1 | tartarus_pce_pcdtbt |
C1=C(c2scc3ccsc23)[SiH2]c2c1[se]c1c2ccc2ccc3nsnc3c21 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4cnc5c6[se]ccc6c6ccccc6c5c4c4cscc34)c2C1 | tartarus_pce_pcdtbt |
C1=c2c(c3c4cnccc4[se]c3c3sc(-c4ccco4)cc23)=C[SiH2]1 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4ccc5c([nH]c6cc[se]c65)c4c4c3=CCC=4)c2C1 | tartarus_pce_pcdtbt |
C1=c2ccc3c4c(c5cc6cc(-c7scc8[se]ccc78)[nH]c6cc5c3c2=CC1)=CCC=4 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cnc4c(c3)sc3c4[se]c4ccc5c[nH]cc5c43)c2[SiH2]1 | tartarus_pce_pcdtbt |
C1=C(c2scc3cc[se]c23)[SiH2]c2c1oc1ccccc21 | tartarus_pce_pcdtbt |
C1=Cc2[nH]c3c(c2C1)c1nsnc1c1cc(-c2ccc[se]2)c2ccccc2c13 | tartarus_pce_pcdtbt |
C1=CCC(C2=Cc3c(c4[se]c5c(c4c4cscc34)CC=C5)C2)=C1 | tartarus_pce_pcdtbt |
C1=C(c2nccc3nsnc23)Cc2c1ncc1c2oc2cc[se]c21 | tartarus_pce_pcdtbt |
C1=c2c(c3c4cnc(-c5scc6[se]ccc56)cc4[nH]c3c3c2ccc2cocc23)=CC1 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4sc5c(cnc6cc[se]c65)c4c4c[nH]cc34)c2C1 | tartarus_pce_pcdtbt |
C1=c2c(-c3cncc4nsnc34)cc3[se]c4c5ncccc5oc4c3c2=CC1 | tartarus_pce_pcdtbt |
c1cnc2c(c1)[nH]c1c3[se]ccc3c3cscc3c21 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4[se]c5c6[nH]ccc6c6cscc6c5c4c4c3=CCC=4)c2[SiH2]1 | tartarus_pce_pcdtbt |
C1=c2c(-c3scc4[se]ccc34)cc3oc4c(ccc5ccc6cscc6c54)c3c2=C[SiH2]1 | tartarus_pce_pcdtbt |
c1cncc(-c2ccc3c(c2)ncc2cc4ccc5nsnc5c4cc23)c1 | tartarus_pce_pcdtbt |
c1ccc2c(c1)c1ccsc1c1c3c[nH]cc3c3cc(-c4scc5ccsc45)[se]c3c21 | tartarus_pce_pcdtbt |
c1cc2c(-c3cc4cc5c6cscc6c6ccc7cocc7c6c5cc4[se]3)scc2o1 | tartarus_pce_pcdtbt |
c1csc(-c2cc3c4c[nH]cc4c4c5[nH]ccc5[se]c4c3o2)n1 | tartarus_pce_pcdtbt |
C1=c2c(c3c(ccc4cc(-c5scc6cc[nH]c56)[se]c43)c3ncccc23)=CC1 | tartarus_pce_pcdtbt |
c1ccc(-c2cc3[se]c4c(ncc5ccc6cocc6c54)c3c3nsnc23)nc1 | tartarus_pce_pcdtbt |
C1=C(c2scc3[se]ccc23)[SiH2]c2c1c1c(c3c2sc2cccnc23)=CCC=1 | tartarus_pce_pcdtbt |
C1=Cc2[nH]c3c([se]c4cc(-c5ccccn5)cnc43)c2C1 | tartarus_pce_pcdtbt |
c1cncc(-c2cc3c4cscc4c4c(ccc5ccc6cocc6c54)c3c3cocc23)c1 | tartarus_pce_pcdtbt |
c1ccc2c(c1)ccc1sc3c(ccc4cc(-c5scc6[se]ccc56)c5nsnc5c43)c12 | tartarus_pce_pcdtbt |
C1=Cc2csc(-c3cc4cc5cnc6ccc7nsnc7c6c5cc4s3)c2[SiH2]1 | tartarus_pce_pcdtbt |
C1=c2c(c3cc(-c4cccc5ccccc45)c4cocc4c3c3[se]ccc23)=C[SiH2]1 | tartarus_pce_pcdtbt |
c1cc(-c2cc3c4cscc4c4c([nH]c5ccoc54)c3[se]2)c2nsnc2c1 | tartarus_pce_pcdtbt |
c1ccc(-c2cc3[se]c4c5cnccc5cnc4c3cn2)nc1 | tartarus_pce_pcdtbt |
c1cnc2c(c1)[se]c1c3ncccc3c3ccccc3c21 | tartarus_pce_pcdtbt |
c1ccc2c(c1)ccc1[se]c3c4oc(-c5scc6ccsc56)cc4c4cocc4c3c12 | tartarus_pce_pcdtbt |
C1=c2cccc(-c3cc4c5nsnc5c5c([nH]c6cc[se]c65)c4[se]3)c2=CC1 | tartarus_pce_pcdtbt |
c1cc2c3cscc3c3c4[nH]c(-c5cncc6nsnc56)cc4c4nsnc4c3c2cn1 | tartarus_pce_pcdtbt |
c1cc2csc(-c3cc4oc5c([se]c6ccc7c[nH]cc7c65)c4c4c[nH]cc34)c2o1 | tartarus_pce_pcdtbt |
C1=C(c2ccc[se]2)Cc2c1c1c(c3c2cnc2cccnc23)=CCC=1 | tartarus_pce_pcdtbt |
C1=Cc2cc3c(cc2C1)c1c2ccccc2c(-c2scc4cc[se]c24)cc1c1nsnc31 | tartarus_pce_pcdtbt |
C1=Cc2c(c3cc4c(cc(-c5ccc[se]5)c5c[nH]cc54)cc3c3ccccc23)[SiH2]1 | tartarus_pce_pcdtbt |
C1=c2c(-c3scc4ccoc34)cc3[se]c4c(ncc5ccc6cscc6c54)c3c2=C[SiH2]1 | tartarus_pce_pcdtbt |
c1ccc2c(c1)c1ccsc1c1[nH]c3cc(-c4scc5sccc45)[nH]c3c21 | tartarus_pce_pcdtbt |
C1=c2c(-c3ccccc3)cc3c4cscc4c4c([nH]c5ccc6nsnc6c54)c3c2=CC1 | tartarus_pce_pcdtbt |
C1=Cc2c(c3c4c(c5cc(-c6cncs6)[se]c5c3c3cocc23)=C[SiH2]C=4)C1 | tartarus_pce_pcdtbt |
c1cc2c(-c3cc4cc5c6cocc6c6ccc7cocc7c6c5cc4[se]3)scc2[se]1 | tartarus_pce_pcdtbt |
C1=Cc2c(c3oc4cc(-c5scc6cc[se]c56)cnc4c3c3c[nH]cc23)[SiH2]1 | tartarus_pce_pcdtbt |
c1ccc(-c2cc3ncc4c5cnccc5c5c[nH]cc5c4c3[se]2)cc1 | tartarus_pce_pcdtbt |
C1=C(c2ccccc2)Cc2c1[se]c1c2c2cocc2c2ccc3c(c21)=CCC=3 | tartarus_pce_pcdtbt |
c1coc(-c2sc(-c3sc(-c4scc5nccnc45)c4ccsc34)c3ccoc23)c1 | tartarus_pce_pcdtbt |
C1=C(c2scc3ccsc23)Cc2c1ncc1c2[se]c2ccsc21 | tartarus_pce_pcdtbt |
c1ccc2c(c1)c1cc[se]c1c1[se]c3cc(-c4ncncn4)ccc3c21 | tartarus_pce_pcdtbt |
C1=C(c2scc3ccsc23)Cc2c1ccc1c2ccc2ccc3nsnc3c21 | tartarus_pce_pcdtbt |
c1ccc(-c2cc3cnc4c5ccccc5[se]c4c3c3nsnc23)cc1 | tartarus_pce_pcdtbt |
c1cc2c(-c3cc4cc5[se]c6ccc7nsnc7c6c5cc4c4cocc34)scc2[nH]1 | tartarus_pce_pcdtbt |
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