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SCFBio, IIT Delhi Hauz Khas, New Delhi

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
Riccardin C
424.50
6.5
3
4
69.92
0
Glutinone
424.70
8.9
0
1
17.07
0
(1R,2R,3R,6R,8S,12S,13S,14R,15R,16S,17R)-2,3,12,15,16,19-hexahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione
426.40
-2.9
6
10
173.98
0
(1S,2R,4S,5R,10S,14S,17R)-5-[(2R)-2-hydroxy-1-methylsulfonylpropan-2-yl]-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.02,4.04,9.014,17]heptadec-8-ene-7,15-dione
426.50
0.2
1
8
127.88
3
6-Hydroxystigmasta-4,22-dien-3-one
426.70
7.2
1
2
37.3
5
Pachysamine E
428.70
7.3
1
2
32.34
4
Sulfurein
432.40
0.7
6
10
166.14
4
Solstitialin
280.32
0
3
5
86.99
1
Digicitrin
434.40
3.1
2
10
126.05
7
Artobiloxanthoe
434.40
4.8
4
7
120.36
1
Solstitialin A 13-acetate
322.40
0
2
6
93.06
3
Cannflavin A
436.50
6.4
3
6
100.13
7
30-Oxolupeol
440.70
8.5
1
2
37.3
2
(2E)-3-phenyl-2-propen-1-yl-6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
442.50
-1.6
6
10
158.3
7
TR-2 Mycotoxin
429.50
-0.3
4
6
126.33
3
9-methoxy-7-[2-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one
444.40
0.9
3
10
137.05
4
[(4aR,4bR,7R,8aR,9R,10aR)-3-acetyloxy-7-ethenyl-8a-hydroxy-1,1,4a,7-tetramethyl-2,5,8-trioxo-6,9,10,10a-tetrahydro-4bH-phenanthren-9-yl] acetate
446.50
1.8
1
8
124.04
5
Dihydrocycloartomunin
450.50
5.8
3
7
109.36
4
Tetracosanoic acid, 24-hydroxy-, 2,3-dihydroxypropyl ester
458.70
9.1
3
5
86.99
27
(3S,8R,9R,10R,12R,14R,17S)-4,4,8,10,14-pentamethyl-17-[(2S)-2,6,6-trimethyloxan-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
460.70
6.9
2
3
49.69
1
rel-(6R,8S)-6,8-Hentriacontanediol
468.80
13.8
2
2
40.46
28
plagiochin A
470.50
6.1
4
6
99.38
1
(1S,11S,14S,15R,20R)-20-hydroxy-8,8,14,15,19,19-hexamethyl-21-oxahexacyclo[18.2.2.01,18.02,15.05,14.06,11]tetracos-4-ene-11-carboxylic acid
470.70
6.5
2
4
66.76
1
methyl 2-[(5R,14R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoate
470.70
7.8
1
3
46.53
6
(3S,4aR,6aR,6bS,8R,8aS,11S,12aS,14aR,14bR)-8a,11-bis(hydroxymethyl)-4,4,6a,6b,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
474.70
5.4
4
4
80.92
2
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