0 B26R3.11436669 CN(C)CCCC1(OCc2cc(C=O)ccc12)c3ccc(F)cc3 Amb22054702 [0,0,0,0,0,0|1,0,1]=2 1 B26R3.11436669 CN(C)CCC[C@@]1(OCc2cc(ccc12)C#N)c3ccc(F)cc3 Amb19295773 [0,0,0,0,0,0|0,0,0]=0 2 B26R3.11436669 CN(C)CCC[C@]1(OCc2cc(ccc12)C#N)c3ccc(F)cc3 Amb22388489 [0,0,0,0,0,0|0,0,0]=0 3 B26R3.11436669 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c3ccc(cc3)Cl Amb17610833 [0,0,0,0,0,0|0,1,0]=1 4 B26R3.11436669 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c3ccc(cc3)Cl Amb17610834 [0,0,0,0,0,0|0,1,0]=1 5 B26R3.11436669 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c3ccc(cc3)F Amb10609438 [0,0,0,0,0,0|0,0,0]=0 6 B26R3.11436669 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c3ccc(cc3)F Amb15690642 [0,0,0,0,0,0|0,0,0]=0 7 B26R3.11436669 N#Cc1ccc2c(c1)CO[C@]2(CCCN(C)C)c3ccc(cc3)F Amb2444021 [0,0,0,0,0,0|0,0,0]=0 8 B25R3.8933218 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c3ccccc3 Amb17612076 [1,0,0,0,0,0|0,0,0]=1 9 B25R3.56151831 CNCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)Cl Amb17611752 [1,0,0,0,0,0|0,1,0]=2 10 B25R3.56151831 CNCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17611754 [1,0,0,0,0,0|0,0,0]=1 11 B25R3.56151831 CNCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17611755 [1,0,0,0,0,0|0,0,0]=1 12 B25R3.56151831 CNCCC[C@@]1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17612158 [1,0,0,0,0,0|0,0,0]=1 13 B25R3.56151831 CNCCC[C@@]1(OCc2cc(ccc12)C#N)c3ccc(F)cc3 Amb19131649 [1,0,0,0,0,0|0,0,0]=1 14 B25R3.448640107 CN(CCCC1(OCc2c1ccc(c2)Br)c3ccc(cc3)F)C Amb17609967 [1,0,0,0,0,0|1,0,0]=2 15 B25R3.448640107 CN(CCCC1(OCc2c1ccc(c2)Cl)c3ccc(cc3)F)C Amb17610856 [1,0,0,0,0,0|1,0,0]=2 16 B27R3.13596562 N#Cc1ccc2c(c1)COC2(CCC[N+](C)(C)[O-])c3ccc(cc3)F Amb17611207 [0,1,0,0,0,0|0,0,1]=2 17 B27R3.13596562 N#Cc1ccc2c(c1)CO[C@]2(CCC[N+](C)(C)[O-])c3ccc(cc3)F Amb17611209 [0,1,0,0,0,0|0,0,1]=2 18 B27R3.47322265 CN(C)CCCC1(OCc2cc(ccc12)C#[N+][O-])c3ccc(F)cc3 Amb22054739 [0,1,0,0,0,0|0,0,1]=2 19 B27R3.124869282 N#Cc1ccc2c(c1)C(=O)OC2(CCCN(C)C)c3ccc(cc3)F Amb17619011 [0,1,0,0,0,0|0,0,1]=2 20 B27R3.124869282 N#Cc1ccc2c(c1)C(O)OC2(CCCN(C)C)c3ccc(cc3)F Amb17615223 [0,1,0,0,0,0|0,0,0]=1 21 B25R3.8971218 N#Cc1cc2CO[C@@](CCC(O)=O)(c2cc1)c3ccc(F)cc3 Amb19131799 [0,0,0,0,1,0|3,0,0]=4 22 B24R3.39903821 NCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)Cl Amb17612688 [2,0,0,0,0,0|0,1,0]=3 23 B24R3.39903821 NCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17612689 [2,0,0,0,0,0|0,0,0]=2 24 B24R3.39903821 NCCCC1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17612690 [2,0,0,0,0,0|0,0,0]=2 25 B24R3.39903821 NCCC[C@@]1(OCc2c1ccc(c2)C#N)c3ccc(cc3)F Amb17612692 [2,0,0,0,0,0|0,0,0]=2 26 B26R2.37476935 CN(C)CCC[C@@](O)(c1ccc(cc1CO)C#N)c2ccc(F)cc2 Amb22744986 [0,1,1,0,0,0|0,0,0]=2 27 B26R2.37476935 OCc1cc(C#N)ccc1C(c2ccc(cc2)Cl)(CCCN(C)C)O Amb17613188 [0,1,1,0,0,0|0,1,0]=3 28 B26R2.37476935 OCc1cc(C#N)ccc1C(c2ccc(cc2)F)(CCCN(C)C)O Amb15690761 [0,1,1,0,0,0|0,0,0]=2 29 B26R2.37476935 OCc1cc(C#N)ccc1C(c2ccc(cc2)F)(CCCN(C)C)O Amb15692793 [0,1,1,0,0,0|0,0,0]=2