0 B9R0.45 CCCCCCCCCI M10191776P [0,0,0,0,0,0|1,0,2]=3 1 B9R0.45 CCCCCCCCNC M10043978P [0,0,0,0,0,0|2,0,2]=4 2 B9R0.45 CCCCCC\C=C\C=O M10157563P [0,0,0,0,0,0|0,0,4]=4 3 B9R0.45 CCCC\C=C\C=C\C=O M10081789P [0,0,0,0,0,0|0,0,4]=4 4 B9R0.45 ClCCOCCOCCO M10069568P [0,0,0,0,0,0|3,0,1]=4 5 B9R0.45 NCCOCCOCCO M10090455P [0,0,0,0,0,0|3,0,1]=4 6 B9R0.45 OCCCCCCCCBr M10256068P [0,0,0,0,0,0|1,0,2]=3 7 B9R0.45 OCCNCCNCCO M10063304P [0,0,0,0,0,0|3,0,1]=4 8 B8R0.4 BrCCCCCCCBr M10064364P [1,0,0,0,0,0|2,0,1]=4 9 B8R0.4 C#CCCCCCCO M10022227P [1,0,0,0,0,0|0,0,3]=4 10 B8R0.4 CCCCCCCCI M10017037P [1,0,0,0,0,0|1,0,1]=3 11 B8R0.4 CCCCC\C=C\C=O M10045247P [1,0,0,0,0,0|0,0,2]=3 12 B8R0.4 CCCCNCCCC M10087124P [1,0,0,0,0,0|1,0,2]=4 13 B8R0.4 OCCCCCCCO M10017038P [1,0,0,0,0,0|1,0,1]=3 14 B8R0.4 OCCCNCCCO M10128009P [1,0,0,0,0,0|2,0,1]=4 15 B10R0.4 O=C(O)COCCCCCC M12277225P [0,1,0,0,0,0|1,0,2]=4 16 B10R0.71 BrCCCCCCCCCBr M10064366P [0,1,0,0,0,0|1,0,2]=4 17 B10R0.71 CCCCCCCCCCCl M10024870P [0,1,0,0,0,0|1,0,2]=4 18 B10R0.71 CCCCCCCCCCI M10039470P [0,1,0,0,0,0|1,0,2]=4 19 B10R0.71 COCCOCCOCCO M10003893P [0,1,0,0,0,0|2,0,1]=4 20 B10R0.91 CCCCC(OCCCC)=O M10015063P [0,1,0,0,0,0|2,0,1]=4 21 B10R1.17 OCCCC1CCNCC1 M10100376P [0,0,0,1,0,0|1,0,2]=4 22 B10R1.17 OCCCC1CCNCC1 M10782360P [0,0,0,1,0,0|1,0,2]=4 23 B10R1.17 OCCCN1CCCCC1 M10003171P [0,0,0,1,0,0|1,0,1]=3 24 B10R1.17 OCCOC1CCCCO1 M10040655P [0,0,0,1,0,0|2,0,1]=4 25 B10R1.20 OCC1C(CO)CCCC1 M10052221P [0,0,0,1,0,0|1,0,2]=4 26 B10R1.20 OCC1C(CO)CCCC1 M10412301P [0,0,0,1,0,0|1,0,2]=4 27 B10R1.20 OC[C@H]1[C@H](CO)CCCC1 M10190924P [0,0,0,1,0,0|1,0,2]=4 28 B10R1.21 BrCCCCC1OCCO1 M10510913P [0,0,0,1,0,0|2,0,1]=4 29 B10R1.21 CCCCCC1=CC=CS1 M10066871P [0,0,0,1,0,0|0,1,2]=4 30 B10R1.85 ClCCN1CCCCCC1 M10194120P [0,0,0,1,0,0|2,0,1]=4 31 B10R1.85 OCCN1CCCCCC1 M10166574P [0,0,0,1,0,0|1,0,1]=3 32 B7R0.1 CCCCCCCI M10061657P [2,0,0,0,0,0|1,0,0]=3 33 B7R0.1 CCCCOCCCl M10115661P [2,0,0,0,0,0|2,0,0]=4 34 B7R0.1 CCOCCOCC M10017029P [2,0,0,0,0,0|2,0,0]=4 35 B7R0.1 ICCCCCCI M10017025P [2,0,0,0,0,0|2,0,0]=4 36 B7R0.1 NCCCCCCN M10083288P [2,0,0,0,0,0|2,0,0]=4 37 B11R0.4 CCCC(OC\C=C\CCC)=O M10270404P [0,2,0,0,0,0|1,0,1]=4 38 B11R0.155 CCCCCC(C(OCC)=O)=O M10120553P [0,2,0,0,0,0|2,0,0]=4 39 B11R0.40 CCCCCCCCC(O)CO M10027137P [0,2,0,0,0,0|0,0,2]=4 40 B9R1.8 CCCC1CCCCC1 M10034652P [1,0,0,1,0,0|0,0,2]=4 41 B9R1.8 CCOC1CCC=CO1 M10003099P [1,0,0,1,0,0|2,0,0]=4 42 B9R1.8 COCC1CNCCO1 M10783644P [1,0,0,1,0,0|2,0,0]=4 43 B9R1.8 N#CCC1=CCCCC1 M10099831P [1,0,0,1,0,0|1,0,1]=4 44 B9R1.8 NCCC1CCCCC1 M10076838P [1,0,0,1,0,0|1,0,1]=4 45 B9R1.8 OCCC1CCCCC1 M10063359P [1,0,0,1,0,0|0,0,1]=3 46 B9R1.8 OCCC1CCNCC1 M10599588P [1,0,0,1,0,0|1,0,1]=4 47 B9R1.8 OCCC1CNCCC1 M10145092P [1,0,0,1,0,0|1,0,1]=4 48 B9R1.12 BrCCCC1OCCO1 M10375402P [1,0,0,1,0,0|2,0,0]=4 49 B9R1.12 CCCCC1C=CC=C1 M10596335P [1,0,0,1,0,0|0,0,2]=4 50 B9R1.12 OCCCN1CCCC1 M10162297P [1,0,0,1,0,0|1,0,1]=4 51 B9R1.15 O[C@H]1[C@H](NC)CCCC1 M10171206P [1,0,0,1,0,0|1,0,1]=4 52 B9R1.33 CN1[C@H](CCO)CCC1 M10348642P [1,0,0,1,0,0|1,0,1]=4 53 B9R1.103 N1CCCCCCCC1 M10078823P [1,0,0,1,0,0|1,0,1]=4