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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
Berbacolorflammine
605.70
6.7
1
7
73.5
3
Alkhanin
264.32
0.9
1
4
63.6
0
(3S,3aS,5aR,6S,9bS)-6-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione
264.32
0.9
1
4
63.6
0
(3S,3aS,5aR,6R,9bS)-6-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione
264.32
0.9
1
4
63.6
0
Alkhanol
266.33
0.6
2
4
66.76
0
(3S,3aS,5aR,6S,8R,9bS)-6,8-dihydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,8,9b-octahydrobenzo[g][1]benzofuran-2-one
266.33
0.6
2
4
66.76
0
(3S,3aS,5aR,6R,8R,9bS)-6,8-dihydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,8,9b-octahydrobenzo[g][1]benzofuran-2-one
266.33
0.6
2
4
66.76
0
Armefolin
264.32
0.4
2
4
66.76
0
Deoxycytidine 5'-monophosphate
307.20
-3.4
4
7
166.94
4
8-Hydroxy-4-methylindeno[1,2-b]pyridin-5-one
211.22
2
1
3
50.19
0
[(3R)-5-[(1S,4aR,5S,8aR)-5-formyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpentyl] acetate
348.50
5.4
0
3
43.37
8
5-(5-acetyloxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
364.50
5.5
1
4
63.6
8
(1S,4aR,5S,8aR)-5-[(3R)-5-acetyloxy-3-methylpentyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
364.50
5.5
1
4
63.6
8
1-(1,3-Benzodioxol-5-ylmethyl)-6,7-dimethoxy-4-(1-methylpyrrolidin-2-yl)isoquinoline
406.50
4.2
0
6
53.05
5
Zeylasterone
510.60
6.6
3
7
121.13
3
Kamebakaurin
350.40
1.4
4
5
97.99
1
Kamebakaurinin
350.40
1
4
5
97.99
1
15,18-Dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
362.50
1.8
2
5
75.99
1
5,6,17-Trimethoxy-10-azatetracyclo[8.8.0.01,14.03,8]octadeca-3,5,7,14-tetraen-9-one
343.40
2.1
0
4
48
3
(1R,17S)-5,6,17-trimethoxy-10-azatetracyclo[8.8.0.01,14.03,8]octadeca-3,5,7,14-tetraen-9-one
343.40
2.1
0
4
48
3
N,N-Dimethyl-L-tryptophan Hydrochloride
232.28
-0.1
2
3
56.33
4
Picrasidine T
481.50
4.5
4
5
107.27
3
(6aS,11aS)-9-methoxy-10-(3-methylbut-2-enyl)-6,11a-dihydro-[1]benzofuro[3,2-c]chromene-3,6a,8-triol
370.40
3.1
3
6
88.38
3
(6aS,11aS)-10-(3-hydroxy-3-methylbutyl)-8,9-dimethoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromene-3,6a-diol
402.40
2.1
3
7
97.61
5
(7-oxo-5,6-dihydropyrrolizin-1-yl)methyl (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
295.33
0.4
2
5
88.76
6
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