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Chemical Library

Physicochemical properties (MW, LogP) of all entries.

Total Rows 105,909
Pages 4,237
BIMP_ID Name Mol Weight LogP HBD HBA TPSA Rotatable Bonds
(3aS,6S,6aR,9aR,9bS)-6-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylidene-3a,4,5,6a,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
278.30
-0.5
2
5
83.83
1
CID 14163580
404.50
1.7
1
7
98.5
4
Isoteuflifin
344.40
0.8
1
6
85.97
1
(3aS,4R,5S,8S,8aR)-3,8-dimethyl-5-[(2R)-6-methylhept-5-en-2-yl]-3a,4,5,6,7,8a-hexahydro-1H-azulene-4,8-diol
306.50
4.3
2
2
40.46
4
[(1R,2R,4S,5S,6R,10R,11S,12R,15R,16R,18S,19R)-4,16-diacetyloxy-6-(furan-3-yl)-11-hydroxy-1,5,10,15-tetramethyl-13-oxapentacyclo[10.6.1.02,10.05,9.015,19]nonadec-8-en-18-yl] (E)-2-methylbut-2-enoate
610.70
4.7
1
9
121.5
8
[(1S,4S,5R,8R,10S,13R,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-23-oxo-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl] acetate
498.70
8
0
4
52.6
2
2-Aminononadecane
283.50
8.6
1
1
26.02
16
(1S,2R,3R,7S,8S)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1,2,7-triol
189.21
-1.7
4
5
84.16
1
(3R,3aS,6E,10E,11aS)-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
234.33
2.9
0
2
26.3
0
4',5,7-Trihydroxy-3-methoxyflavanone
302.28
2.4
3
6
96.22
2
(3aR,4aR,5R,6R,8aR,9aR)-6-hydroxy-8a-methyl-3-methylidenespiro[3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-5,2'-oxirane]-2-one
264.32
1.4
1
4
59.06
0
[(1R,2S,4aR,5R,8aS)-5-hydroxy-4a-methyl-8-methylidene-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalen-1-yl] (E)-3-phenylprop-2-enoate
368.50
5.3
1
3
46.53
5
Isonardosinone
250.33
2.3
1
3
49.83
1
(1S,2R,3R,9S,12S)-12-hydroxy-2,3,11,11-tetramethyl-10-oxatricyclo[7.2.1.02,7]dodec-6-en-8-one
250.33
2.3
1
3
46.53
0
(1aS,4R,6R,6aR,7S,7aS)-4-hydroxy-7-(2-hydroxypropan-2-yl)-6,6a-dimethyl-1a,4,5,6,7,7a-hexahydronaphtho[2,3-b]oxiren-2-one
266.33
1
2
4
70.06
1
(1aS,6R,6aR,7S,7aS)-7-(2-hydroxypropan-2-yl)-6,6a-dimethyl-5,6,7,7a-tetrahydro-1aH-naphtho[2,3-b]oxirene-2,4-dione
264.32
0.9
1
4
66.9
1
16-Acetoxy-7-O-Acetylhorminone
432.50
3.1
1
7
106.97
6
DELTA6-Dehydroferruginol
284.40
6.5
1
1
20.23
1
[(1S,4R,5aS,9aS,9bR)-1-acetyloxy-6,6,9a-trimethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzofuran-4-yl] acetate
336.40
3.5
0
5
61.83
4
Hysterin
308.40
2
1
5
72.83
3
[(3aS,6S,6aR,9S,9aS,9bR)-6a,9-dihydroxy-6-methyl-3-methylidene-2-oxo-3a,4,5,6,7,8,9,9b-octahydroazuleno[4,5-b]furan-9a-yl]methyl acetate
324.40
1
2
6
93.06
3
7-Hydroxycostol
236.35
3.1
2
2
40.46
2
N-N-BIS(beta-CHLOROETHYL)-p-TOLUENESULFONAMIDE
234.33
3
1
2
37.3
2
7-Hydroxycostal
234.33
3
1
2
37.3
2
1-(7-methyl-4-methylidene-2,3,4a,5,6,8a-hexahydro-1H-naphthalen-1-yl)ethanone
204.31
2.2
0
1
17.07
1
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