0  B15R2.15371  c1cc(c(c(c1)Cl)CC2OCCO2)F TS22139 [0,0,0,0,0,0|2,1,1]=4
1  B15R2.15371  c1cc(c(c(c1)Cl)Cc2n[nH]nn2)F TS44257 [0,0,0,0,0,0|2,1,1]=4
2  B15R2.15371  c1cc(c(c(c1)Cl)NC2=NCCN2)Cl TS30349 [0,0,0,0,0,0|1,0,0]=1
3  B14R2.50  c1ccc(c(c1)Cc2n[nH]nn2)Cl TS51934 [1,0,0,0,0,0|2,0,1]=4
4  B16R2.6175  c1c(cc(c(c1Cl)N=C2NCCN2)Cl)I TS80788 [0,1,0,0,0,0|1,0,1]=3
5  B16R2.6175  c1c(cc(c(c1Cl)N=C2NCCN2)Cl)N TS27280 [0,1,0,0,0,0|1,0,1]=3
6  B16R2.6175  c1c(cc(c(c1Cl)NC2=NCCN2)Cl)N TS34360 [0,1,0,0,0,0|1,0,0]=2
7  B14R1.19171  CCOC(=O)Cc1c(cccc1Cl)F TS55912 [0,0,1,0,0,0|2,1,0]=4
8  B14R2.4572  Cc1csc(c1NC2=NCCN2)Cl TS44761 [0,0,0,0,1,0|3,0,0]=4
9  B16R2.3259  c1cc(c(c(c1)Cl)CN2CCNCC2)Cl TS62128 [0,0,0,0,0,1|3,0,0]=4
10  B13R1.4928  COC(=O)Cc1c(cccc1Cl)Cl TS49546 [1,0,1,0,0,0|2,0,0]=4
11  B13R1.8919  c1cc(c(c(c1)Cl)CSCCN)F TS08931 [1,0,1,0,0,0|1,1,0]=4
12  B13R2.64  c1ccc(cc1)CC2=NCCN2 TS11292 [2,0,0,0,0,0|0,0,0]=2
13  B13R2.64  c1ccc(cc1)CC2=NCCN2 TS53778 [2,0,0,0,0,0|0,0,0]=2
14  B13R2.64  c1ccc(cc1)CC2CCCN2 TS42354 [2,0,0,0,0,0|1,0,1]=4
15  B13R2.64  c1ccc(cc1)Cc2[nH]nnn2 TS42164 [2,0,0,0,0,0|2,0,0]=4
16  B15R2.1154  Cc1ccc(c(c1)Cl)NC2=NCCN2 TS20822 [1,1,0,0,0,0|1,0,0]=3
17  B15R2.7567  Cc1ccc(cc1NC2=NCCN2)F TS51646 [1,1,0,0,0,0|2,0,0]=4
18  B17R2.41794  CC(C1=NCCN1)Oc2c(cccc2Cl)Cl TS93669 [0,1,0,0,0,1|0,0,0]=2
19  B17R2.41794  C[C@@H](C1=NCCN1)Oc2c(cccc2Cl)Cl TS29316 [0,1,0,0,0,1|0,0,0]=2
20  B17R3.4464  c1cc2c(c(c1)Cl)CN(C2)C3=NCCN3 TS68101 [0,0,0,1,0,1|1,0,0]=3
21  B13R1.4453  CCOC(=O)c1c(cccc1Cl)Cl TS22543 [0,0,1,0,1,0|2,0,0]=4
22  B13R2.18  c1ccc(c(c1)C2=NCCC2)Cl TS47803 [1,0,0,0,1,0|1,0,0]=3
23  B13R2.18  c1ccc(c(c1)C2=NCCN2)S TS14263 [1,0,0,0,1,0|1,0,0]=3
24  B13R2.18  c1ccc(c(c1)C2CCCN2)Cl TS08218 [1,0,0,0,1,0|1,0,1]=4
25  B13R2.18  c1ccc(c(c1)c2[nH]nnn2)Cl TS14693 [1,0,0,0,1,0|2,0,0]=4