0 B16R1.11435 CC(=C)C(=O)OC1CC(C)CCC1C(C)C Amb17934080 [0,0,0,0,0,0|1,0,1]=2 1 B16R1.11435 CC(=C)C(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb17934079 [0,0,0,0,0,0|1,0,1]=2 2 B16R1.11435 CC(=O)C(=O)OC1CC(C)CCC1C(C)C Amb22546812 [0,0,0,0,0,0|0,0,2]=2 3 B16R1.11435 CC(C)C1CCC(C)CC1NC(=O)[C@@H](C)N Amb25393707 [0,0,0,0,0,0|2,0,0]=2 4 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C(O)O Amb22045237 [0,0,0,0,0,0|1,0,0]=1 5 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H](C)O Amb22338441 [0,0,0,0,0,0|0,0,0]=0 6 B16R1.11435 CC1CCC(C(C1)OC(=O)C(O)C)C(C)C Amb1953961 [0,0,0,0,0,0|0,0,0]=0 7 B15R1.3825 BrCC(=O)OC1C[C@H](C)CC[C@H]1C(C)C Amb10559469 [1,0,0,0,0,0|1,0,0]=2 8 B15R1.3825 CC(C)C1CCC(C)CC1NC(=O)CBr Amb25770251 [1,0,0,0,0,0|2,0,0]=3 9 B15R1.3825 CC(C)C1CCC(C)CC1OC(=O)C=C Amb17934078 [1,0,0,0,0,0|0,0,2]=3 10 B15R1.3825 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C#C Amb17779643 [1,0,0,0,0,0|0,0,2]=3 11 B15R1.3825 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C=O Amb22800348 [1,0,0,0,0,0|0,0,2]=3 12 B15R1.3825 O=CC(=O)OC1C[C@H](C)CCC1C(C)C Amb16232551 [1,0,0,0,0,0|0,0,2]=3 13 B15R1.3825 OCC(=O)OC1CC(C)CCC1C(C)C Amb1111301 [1,0,0,0,0,0|0,0,0]=1 14 B15R1.8875 CC(C)C1CCCCC1NC(=O)C(C)N Amb25390019 [1,0,0,0,0,0|2,0,0]=3 15 B15R1.8875 CC(C)C1CCCCC1NC(=O)[C@@H](C)N Amb25390017 [1,0,0,0,0,0|2,0,0]=3 16 B15R1.8875 CC(C)C1CCCCC1NC(=O)[C@H](C)N Amb25390020 [1,0,0,0,0,0|2,0,0]=3 17 B15R1.8875 C[C@H](N)C(=O)NC1CCCCC1N(C)C Amb22226065 [1,0,0,0,0,0|3,0,0]=4 18 B17R1.8320 CC(C)C1CCC(C)CC1NC(=O)C(C)CN Amb25403319 [0,1,0,0,0,0|2,0,0]=3 19 B17R1.8320 CC(C)C1CCC(C)CC1NC(=O)[C@@H](N)CC Amb24790147 [0,1,0,0,0,0|2,0,0]=3 20 B17R1.66043 CC(C)C1CCC(C)CC1NC(=O)C(F)(F)F Amb24570112 [0,1,0,0,0,0|3,0,0]=4 21 B15R0.2722 CC(CCOC(=O)C(C)C)CCC=C(C)C Amb17679058 [0,0,1,0,0,0|1,0,2]=4 22 B15R1.8416 CC1CCC(C(C1)C(=O)C(C)C)C(C)C Amb25141919 [0,0,0,0,1,0|1,0,0]=2 23 B15R1.8416 CC1NCC(N(C1)C(=O)C(C)C)C(C)C Amb17579465 [0,0,0,0,1,0|3,0,0]=4 24 B17R1.14621 CC1CC(OC(=O)CC(C)C)C(CC1)C(C)C Amb21520395 [0,0,0,0,0,1|1,0,0]=2 25 B14R0.549 CC(C)CCCCCCNC(=O)C(C)N Amb24770605 [1,0,1,0,0,0|2,0,0]=4 26 B14R1.3135 CC(C)C(=O)NC1CCCCC1CC Amb25205228 [2,0,0,0,0,0|2,0,0]=4 27 B14R1.3135 CC(S)C(=O)NC1CCCCC1CC Amb25058316 [2,0,0,0,0,0|1,1,0]=4 28 B14R1.3135 C[C@@H](N)C(=O)NC1CCCCC1CC Amb19055523 [2,0,0,0,0,0|2,0,0]=4 29 B14R1.164 CC(C)C1CCC(C)CC1CC(C)=C Amb24526829 [2,0,0,0,0,0|2,0,0]=4 30 B14R1.164 CC(C)C1CCC(C)CC1CC(N)=O Amb25200983 [2,0,0,0,0,0|2,0,0]=4 31 B14R1.164 CC(C)C1CCC(C)CC1NC(C)=S Amb24467067 [2,0,0,0,0,0|1,1,0]=4 32 B14R1.164 CC(C)C1CCC(C)CC1NC(N)=O Amb25708464 [2,0,0,0,0,0|2,0,0]=4 33 B14R1.164 CC(C)C1CCC(C)CC1OC(Cl)=O Amb17678766 [2,0,0,0,0,0|1,0,0]=3 34 B14R1.164 CC(C)[C@@H]/1CC[C@@H](C)C\C1=C/C(O)=O Amb25201490 [2,0,0,0,0,0|1,0,1]=4 35 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)CC1CC(O)=O Amb25274086 [2,0,0,0,0,0|1,0,0]=3 36 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OC(C)=O Amb22336235 [2,0,0,0,0,0|0,0,0]=2 37 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(N)=O Amb24563410 [2,0,0,0,0,0|2,0,0]=4 38 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cl Amb20242385 [2,0,0,0,0,0|1,0,0]=3 39 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(C)=O Amb18511844 [2,0,0,0,0,0|0,0,0]=2 40 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(N)=O Amb17844396 [2,0,0,0,0,0|1,0,0]=3 41 B14R1.164 CC(C)[C@@H]1CC[C@H](C)C[C@H]1OC(N)=O Amb25339646 [2,0,0,0,0,0|1,0,0]=3 42 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(N)=O Amb24527797 [2,0,0,0,0,0|2,0,0]=4 43 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(C)=O Amb25315502 [2,0,0,0,0,0|0,0,0]=2 44 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(N)=O Amb24695164 [2,0,0,0,0,0|1,0,0]=3 45 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@H]1OC(C)=O Amb22232055 [2,0,0,0,0,0|0,0,0]=2 46 B14R1.164 C[C@@H]1CC[C@H](C(C1)OC(=O)C)C(C)C Amb10559468 [2,0,0,0,0,0|0,0,0]=2 47 B14R1.164 C[C@@H]1CC[C@H]([C@@H](C1)OC(C)=O)C(C)=C Amb22801079 [2,0,0,0,0,0|0,0,2]=4 48 B14R1.3302 CC(C)C1CCCCC1NC(=O)CBr Amb24639654 [2,0,0,0,0,0|2,0,0]=4 49 B14R1.3302 CC(C)C1CCCCC1NC(=O)CN Amb24645931 [2,0,0,0,0,0|2,0,0]=4 50 B14R1.3302 CC(C)C1CCCCC1NC(=O)OC Amb24720392 [2,0,0,0,0,0|2,0,0]=4 51 B16R1.1519 CC(C)C1CCC(C)CC1OC(=O)OCC Amb22731390 [1,1,0,0,0,0|0,0,0]=2 52 B16R1.1519 N#CCC(=O)OC1CC(C)CCC1C(C)C Amb2386150 [1,1,0,0,0,0|0,0,1]=3 53 B16R1.1302 CC(C)C1CCC(C)CC1OCC(O)CO Amb24061577 [1,1,0,0,0,0|0,0,1]=3 54 B16R1.4120 C[C@@H](N)C(=O)NC1CCCCC1C(C)(C)C Amb25393553 [1,1,0,0,0,0|2,0,0]=4 55 B18R1.6101 CC(C)C1CCC(C)CC1NC(=O)C(N)CCC Amb24796534 [0,2,0,0,0,0|2,0,0]=4 56 B16R2.244811 CC(Br)C(=O)NC1CCC2CC1C2(C)C Amb25229218 [1,0,0,1,0,0|2,0,0]=4 57 B16R2.244811 CC(Cl)C(=O)NC1CCC2CC1C2(C)C Amb24600141 [1,0,0,1,0,0|2,0,0]=4 58 B18R2.530811 CC(C)C1CCC(C)CC1NC(=O)C2CNC2 Amb24791128 [0,1,0,1,0,0|2,0,0]=4 59 B14R1.707 CC(C)C1CCC(C)CC1C(=O)CC Amb25247714 [1,0,0,0,1,0|0,0,0]=2 60 B14R1.707 CC(C)C1CCC(C)CC1C(Br)CC Amb25091443 [1,0,0,0,1,0|1,0,1]=4 61 B14R1.707 CC(C)C1CCC(C)CC1C(O)CC Amb25857713 [1,0,0,0,1,0|0,0,2]=4 62 B14R1.707 CCC(=O)N1CC(C)NCC1C(C)C Amb17578747 [1,0,0,0,1,0|2,0,0]=4 63 B14R1.429 CC(C)C1CCCCC1C(=O)C(C)C Amb24651999 [1,0,0,0,1,0|1,0,0]=3 64 B14R1.429 CC(C)C1CCCCN1C(=O)[C@H](C)N Amb24551986 [1,0,0,0,1,0|2,0,0]=4 65 B18R1.10382 CC(C)C1CCC(C)CC1NC(=O)CCC(C)N Amb24800986 [0,0,0,0,0,2|2,0,0]=4 66 B18R1.10382 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)CCC(O)=O Amb22745847 [0,0,0,0,0,2|1,0,1]=4