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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
Saikogenin B
456.70
6.7
3
3
60.69
1
Saikogenin C
456.70
6.4
3
3
60.69
1
Sakakin
286.28
-0.5
5
7
119.61
3
Orcinol glucoside
286.28
-0.5
5
7
119.61
3
[5-Hydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl benzoate
406.40
0.7
5
9
145.91
7
1H,3H-Furo[3,4-c]furan-1-ol, 4-(1,3-benzodioxol-5-yl)tetrahydro-
250.25
0.8
1
5
57.15
1
Tomentosolic acid
454.70
6.1
2
3
57.53
1
(2E,4E,8E,10Z)-N-(2-methylpropyl)dodeca-2,4,8,10-tetraenamide
247.38
4.2
1
1
29.1
8
(+)-alpha-Santalene
204.35
5.2
0
0
0
3
(Z)-2-methyl-5-[(1S,2S,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
220.35
4
1
1
20.23
4
rel-(1R,2S,3S,4S)-2,3-Dimethylbicyclo[2.2.1]heptan-2-ol
140.22
1.9
1
1
20.23
0
(+)-Santolina alcohol
154.25
2.7
1
1
20.23
3
(3R)-3-ethenyl-2,5-dimethylhexa-1,4-diene
136.23
4.2
0
0
0
3
(3R,3aS,5aS,9R,9aS,9bS)-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione
250.33
2.7
0
3
43.37
0
Saponaroside
618.80
4.7
5
9
153.75
4
Saracodine
402.70
6.1
0
2
23.55
3
(Z)-2-(hydroxymethyl)but-2-enoic acid
116.11
-0.3
2
3
57.53
2
Desacetyl asperulosidic acid
390.34
-3.8
7
11
186.37
5
Deacetylasperulosidic acid
390.34
-3.8
7
11
186.37
5
24alpha-Ethyl-5alpha-cholest-7-en-3beta-ol
414.70
9.1
1
1
20.23
6
delta(7)-Stigmastenol
414.70
9.1
1
1
20.23
6
(3S,5R,9R,10S,13R,14R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
414.70
9.1
1
1
20.23
6
Scillarenin
384.50
2.9
2
4
70.67
1
(3S,10S,13R,14S,17R)-3,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
398.50
1.6
2
5
87.74
2
Scilliphaeoside
546.60
0.7
5
9
149.82
3
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