0 B24R3.115675198 CC(CC1c2ccccc2CCc3ccccc31)CN(C)C Amb22732310 [0,0,0,0,0,0|1,0,0]=1 1 B24R3.115675198 CN(C)CC(C)CN1c2ccccc2CCc3ccccc13 Amb22352116 [0,0,0,0,0,0|0,0,0]=0 2 B24R3.115675198 CN(C)CC(C)CN1c2ccccc2CCc3ccccc13 Amb24122678 [0,0,0,0,0,0|0,0,0]=0 3 B24R3.115675198 CN(CC(CC1c2ccccc2CCc3c1cccc3)C)C Amb17610138 [0,0,0,0,0,0|1,0,0]=1 4 B24R3.115675198 CN(CC(CN1c2ccccc2CCc3c1cccc3)C)C Amb10843746 [0,0,0,0,0,0|0,0,0]=0 5 B23R3.21774393 CNCC(CN1c2ccccc2CCc3c1cccc3)C Amb17611805 [1,0,0,0,0,0|0,0,0]=1 6 B23R3.21774393 CNCC(O)CN1c2ccccc2CCc3ccccc13 Amb22477981 [1,0,0,0,0,0|1,0,0]=2 7 B23R3.26139327 CN(C)CCC=C1c2ccccc2CCc3ccccc31 Amb22492837 [1,0,0,0,0,0|1,0,1]=3 8 B23R3.26139327 CN(C)CCCC1c2ccccc2COc3ccccc31 Amb22442707 [1,0,0,0,0,0|2,0,0]=3 9 B23R3.26139327 CN(C)CCCC1c2ccccc2CSc3ccccc31 Amb24309707 [1,0,0,0,0,0|2,0,0]=3 10 B23R3.26139327 CN(C)CCNC1c2ccccc2CCc3ccccc31 Amb22446491 [1,0,0,0,0,0|2,0,0]=3 11 B23R3.26139327 CN(C)CC\C=C\1/c2ccccc2COc3ccccc31 Amb22233544 [1,0,0,0,0,0|2,0,1]=4 12 B23R3.26139327 CN(C)CC\C=C\1/c2ccccc2COc3ccccc31 Amb22729577 [1,0,0,0,0,0|2,0,1]=4 13 B23R3.26139327 CN(C)CC\C=C\1/c2ccccc2CSc3ccccc31 Amb22729272 [1,0,0,0,0,0|2,0,1]=4 14 B23R3.26139327 CN(C)CC\C=C\1/c2ccccc2CSc3ccccc31 Amb22733111 [1,0,0,0,0,0|2,0,1]=4 15 B23R3.26139327 CN(CCCN1c2ccccc2CCc3c1cccc3)C Amb2444037 [1,0,0,0,0,0|0,0,0]=1 16 B23R3.26139327 CN(CC\C=C\1/c2ccccc2OCc3c1cccc3)C Amb10843677 [1,0,0,0,0,0|2,0,1]=4 17 B23R3.26139327 [13CH3]N([13CH2]CC=C1c2ccccc2CCc3c1cccc3)[13CH3] Amb17608345 [1,0,0,0,0,0|1,0,1]=3 18 B25R3.2617190 CN(CC(CN1c2ccccc2CCc3c1ccc(c3)O)C)C Amb17615931 [0,1,0,0,0,0|0,0,0]=1 19 B25R3.727002033 CC(C[N+](C)(C)[O-])CN1c2ccccc2CCc3c1cccc3 Amb17621085 [0,1,0,0,0,0|0,0,1]=2 20 B23R3.71886310 CN(CC(CN1c2ccccc2Sc3c1cccc3)C)C Amb10843719 [0,0,0,0,1,0|1,0,0]=2 21 B22R3.12627361 CCNCCN1c2ccccc2CCc3ccccc13 Amb22455661 [2,0,0,0,0,0|2,0,0]=4 22 B22R3.12627361 CNCCC=C1c2ccccc2CCc3c1cccc3 Amb1161258 [2,0,0,0,0,0|1,0,1]=4 23 B22R3.12627361 CNCCC=C1c2ccccc2CCc3c1cccc3 Amb2371759 [2,0,0,0,0,0|1,0,1]=4 24 B24R3.32966772 CNCC(C)CN1c2ccccc2CCc3cc(O)ccc13 Amb22055420 [1,1,0,0,0,0|0,0,0]=2 25 B24R3.2438581 CN(CCCN1c2ccccc2CCc3c1ccc(c3)O)C Amb17615436 [1,1,0,0,0,0|0,0,0]=2 26 B24R3.218520876 CN(C)CC\C=C/1\c2ccccc2CC(O)c3ccccc31 Amb24310098 [1,1,0,0,0,0|1,0,1]=4 27 B24R3.218520876 CN(CC\C=C/1\c2ccccc2CC(c3c1cccc3)O)C Amb17615136 [1,1,0,0,0,0|1,0,1]=4 28 B24R3.1505225918 C[N+](C)([O-])CCCN1c2ccccc2CCc3ccccc13 Amb22735068 [1,1,0,0,0,0|0,0,1]=3 29 B24R3.1505225918 [O-][N+](CCCN1c2ccccc2CCc3c1cccc3)(C)C Amb17616057 [1,1,0,0,0,0|0,0,1]=3 30 B24R3.118821253 CN(CC(=O)N1c2ccccc2CCc3c1cc(N)cc3)C Amb1253932 [0,1,0,0,1,0|1,0,1]=4 31 B26R3.187142441 CN(C)CC(C)CN1c2cc(Cl)ccc2OCOc3ccccc13 Amb22473940 [0,1,0,0,0,1|1,0,0]=3 32 B24R4.411822155 CN(C)Cc1c[n]-2c3c1cccc3CCc4ccccc24 Amb22442770 [1,0,0,1,0,0|0,0,2]=4 33 B24R4.13627797 CN1CC(CN2c3ccccc3Sc4ccccc24)CC1 Amb22730444 [0,0,0,1,1,0|1,0,0]=3 34 B24R4.13627797 CN1CCC(C1)CN2c3ccccc3Sc4c2cccc4 Amb17616890 [0,0,0,1,1,0|1,0,0]=3 35 B22R3.13446522 CNCC(C)N1c2ccccc2CCc3ccccc13 Amb22453059 [1,0,0,0,1,0|0,0,0]=2 36 B22R3.16182945 CN(CCCN1c2ccccc2Sc3c1nccc3)C Amb17619630 [1,0,0,0,1,0|2,0,0]=4 37 B22R3.23485149 CN(C)C(C)CN1c2[n]cccc2Sc3ccccc13 Amb22729570 [0,0,0,0,2,0|2,0,0]=4 38 B22R3.41063291 CN(C)CC(C)N1c2ccccc2Sc3ccccc13 Amb23554521 [0,0,0,0,2,0|1,0,0]=3 39 B22R3.41063291 CN(CC(N1c2ccccc2Sc3c1cccc3)C)C Amb17616212 [0,0,0,0,2,0|1,0,0]=3 40 B22R3.41064905 CN(CC(Cn1c2ccccc2c3c1cccc3)O)C Amb2571426 [0,0,0,0,2,0|1,0,0]=3