0 B6R0.2 CC(C)CC(N)=O BCP05941 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.2 CC(C)NC(C)=O BCP19527 [0,0,0,0,0,0|1,0,2]=3 2 B6R0.2 CC(CC(N)=O)=O BCP19964 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.2 CC(OC(C)=O)=O BCP20665 [0,0,0,0,0,0|1,0,0]=1 4 B6R0.2 CC(\C=C([O-])C)=O BCP15074 [0,0,0,0,0,0|2,0,0]=2 5 B6R0.2 C[C@@H](N)CC(O)=O BCP11586 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.2 C[C@@H](N)CC(O)=O BCP16924 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.2 OC(CC(O)=O)=O BCP05571 [0,0,0,0,0,0|4,0,0]=4 8 B5R0.1 CC(OCCl)=O BCP16170 [1,0,0,0,0,0|1,0,1]=3 9 B5R0.1 [S-]C(OCC)=S BCP29024 [1,0,0,0,0,0|1,1,1]=4 10 B7R0.2 C[C@@H](O)CC(OC)=O BCP15245 [0,1,0,0,0,0|2,0,1]=4 11 B7R0.2 C[C](O)CC(OC)=O BCP12973 [0,1,0,0,0,0|2,0,1]=4 12 B7R0.2 O=C(OC)C=C(C)C BCP10333 [0,1,0,0,0,0|1,0,1]=3 13 B7R0.2 O=C(OC)\C=C(N)C BCP15340 [0,1,0,0,0,0|2,0,0]=3 14 B7R1.2 BrC1=CC=C(Br)O1 BCP17059 [0,0,0,1,0,0|2,0,1]=4 15 B7R1.2 CC1=CC=C(C)N1 BCP18596 [0,0,0,1,0,0|2,0,0]=3 16 B7R1.2 CC1=NN=C(C)N1 BCP11310 [0,0,0,1,0,0|3,0,0]=4 17 B7R1.2 NC1=NC=C(C)N1 BCP11475 [0,0,0,1,0,0|3,0,0]=4 18 B7R1.2 O=C1OC[C@@H](C)O1 BCP12993 [0,0,0,1,0,0|1,0,2]=4 19 B5R0.5 C=C(Cl)C(O)=O BCP13841 [0,0,0,0,1,0|2,0,0]=3 20 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [0,0,0,0,1,0|2,0,1]=4 21 B5R0.5 C[C](Cl)C(O)=O BCP11281 [0,0,0,0,1,0|2,0,1]=4 22 B5R0.5 O=C(C)C([O-])=O BCP13503 [0,0,0,0,1,0|2,0,0]=3 23 B4R0.1 C=CC(Cl)=O BCP06212 [2,0,0,0,0,0|1,0,0]=3 24 B4R0.1 CC(CBr)=O BCP06577 [2,0,0,0,0,0|1,0,1]=4 25 B4R0.1 NC(C=C)=O BCP25183 [2,0,0,0,0,0|1,0,0]=3 26 B4R0.1 O=CC(O)=O BCP15407 [2,0,0,0,0,0|2,0,0]=4 27 B6R0.1 O=C(C#N)OCC BCP04941 [1,1,0,0,0,0|0,0,2]=4 28 B6R0.1 O=C(C=C)OCC BCP06341 [1,1,0,0,0,0|0,0,2]=4 29 B6R0.1 O=C(OCC)CBr BCP04940 [1,1,0,0,0,0|0,0,1]=3 30 B6R0.3 C\C=C(C)\C(O)=O BCP18945 [1,1,0,0,0,0|2,0,0]=4 31 B6R0.4 O=C(O)\C=C\CBr BCP11140 [1,1,0,0,0,0|2,0,0]=4 32 B8R0.23 C[C@@H](C(Cl)=O)OC(C)=O BCP04460 [0,1,0,0,0,1|2,0,0]=4 33 B8R0.5 CCOC(\C=C(N)\C)=O BCP12251 [0,2,0,0,0,0|2,0,0]=4 34 B8R0.5 O=C(OC(C)C)OCCl BCP13081 [0,2,0,0,0,0|0,0,2]=4 35 B8R0.19 O=C(OC)CC(CCl)=O BCP19731 [0,2,0,0,0,0|2,0,0]=4 36 B6R1.2 CC1=CC=NO1 BCP11243 [1,0,0,1,0,0|1,0,1]=4 37 B6R1.2 O=C1COCC1 BCP14176 [1,0,0,1,0,0|2,0,0]=4 38 B6R1.2 O=C1NCCC1 BCP15175 [1,0,0,1,0,0|1,0,1]=4 39 B6R1.2 O=C1OCC=C1 BCP15247 [1,0,0,1,0,0|0,0,2]=4 40 B6R1.2 O=c1[nH]cc[nH]1 BCP13352 [1,0,0,1,0,0|2,0,0]=4 41 B8R1.3 CC1=CN=C(C)C=N1 BCP08618 [0,0,0,1,0,1|2,0,0]=4 42 B8R1.3 O=C1C=CC(C)=CN1 BCP20199 [0,0,0,1,0,1|1,0,1]=4 43 B8R1.3 O=C1C=NC(C)=CN1 BCP16191 [0,0,0,1,0,1|2,0,0]=4 44 B8R1.1 Cc1cnc(s1)C=O BCP10107 [0,1,0,1,0,0|1,1,0]=4 45 B8R1.4 NC=1CCCC(C1)=O BCP19985 [0,1,0,1,0,0|2,0,0]=4 46 B8R1.18 C[C]1NC(=O)OC1=O BCP18817 [0,1,0,1,0,0|2,0,0]=4 47 B8R1.18 N=C1NC(CN1C)=O BCP14736 [0,1,0,1,0,0|2,0,0]=4 48 B8R1.50 O=C1CCC(N1Br)=O BCP15478 [0,1,0,1,0,0|2,0,0]=4 49 B8R1.50 O=C1CCC(N1I)=O BCP18538 [0,1,0,1,0,0|2,0,0]=4