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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
Glechomafuran
248.32
2.3
0
3
38.2
0
Ibogamine
280.40
3.9
1
1
19.03
1
methyl (E)-2-[(2S,3Z,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
366.50
2.7
1
4
54.56
4
N(6)-(dimethylallyl)adenosine 5'-monophosphate
415.34
-1.4
5
11
181.89
7
(2S,3R,3aS,6S,7aR)-2-(1,3-benzodioxol-5-yl)-3a,7a-dimethoxy-3-methyl-5-prop-2-enyl-2,3,6,7-tetrahydro-1-benzofuran-6-ol
374.40
2.1
1
6
66.38
5
angelol B
376.40
2.1
2
7
106.2
7
(7R)-7-Hydroxylariciresinol
376.40
1.3
4
7
108.61
6
[(1R,3R,4R,4aS,8aS)-4-hydroxy-3,4a,8,8-tetramethyl-4-[2-(5-oxo-2H-furan-4-yl)ethyl]-2,3,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate
378.50
4.2
1
5
72.83
5
Quercetin 7-O-sulfate
382.30
0.9
5
10
183.11
3
Uncinoside A
382.40
0.7
5
9
149.82
3
(6R,8S)-pentacosane-6,8-diol
384.70
10.5
2
2
40.46
22
Thalmidine
622.70
6.7
0
8
61.86
4
DL-Praeruptorin A
386.40
3.1
0
7
92.04
5
Obaberine
622.70
6.7
0
8
61.86
4
Corchoionoside A
388.50
-0.5
5
8
132.14
5
5,7-dihydroxy-4-[(1S)-1-hydroxypropyl]-8-(2-methylbutanoyl)-6-(3-methylbut-2-enyl)chromen-2-one
388.50
4.4
3
6
107.97
7
clauslactone C
392.40
0.8
3
9
135.66
4
US9328123, Rotenone
394.40
4.1
0
6
63.22
3
Xanthone V1a
396.40
5.9
4
6
111.13
4
(3Z,4R,5R)-4-hydroxy-5-methoxy-5-methyl-3-octadecylideneoxolan-2-one
396.60
8.6
1
4
55.76
17
Niaziminin
399.50
1.3
3
8
138.57
8
(-)-(7R,8S,7'E)-3,4,5,5'-tetramethoxy-4',7-epoxy-8,3'-neolign-7'-ene-9,9'-diol
402.40
2.2
2
7
86.61
8
Digitopurpone
270.24
3.3
3
5
94.83
0
[(3R,4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]-(3,4,5-trimethoxyphenyl)methanone
416.40
2
1
8
92.68
7
(5E)-4-methoxy-3-methyl-5-[(1S,2R,3S,6R,11S)-3-methyl-11-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-5-oxa-10-azatricyclo[8.3.0.02,6]tridecan-4-ylidene]furan-2-one
417.50
3
0
7
74.3
2
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