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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
3,6-dimethyl-1-[(E)-3-methylbut-1-enyl]-9H-carbazole
263.40
5.9
1
0
15.79
2
8a-Hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione
268.30
1.2
1
5
72.83
0
2,2-Dimethyloxirane
72.11
0.5
0
1
12.53
0
(1R,10S,12R)-4-methoxy-9-azatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6,13-tetraene-5,12-diol
273.33
1.5
2
4
52.93
1
Vitex norditerpenoid 1
290.40
5
0
2
26.3
1
7-Methoxy-8-phenylfuro[3,2-h]chromen-6-one
292.30
3.8
0
4
52.58
2
glybomine B
295.40
5.3
2
2
45.25
3
(+)-Isofebrifugine
301.34
0.1
2
5
84.22
4
Avicenol A
304.34
2.6
2
5
68.15
3
(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
306.27
-0.8
6
7
130.61
1
(E)-N-[(2S)-2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enamide
311.40
3
1
3
47.56
7
(+)-Bractazonine
313.40
3.5
1
4
41.93
2
[8-(3,4-Dimethoxyphenyl)-6-hydroxyoctan-4-yl] acetate
324.40
3.4
1
5
64.99
11
(1S,9R,12R)-4-hydroxy-1,11,11-trimethyl-8,10-dioxo-5-propan-2-yltricyclo[7.3.1.02,7]trideca-2,4,6-triene-12-carbaldehyde
328.40
3.3
1
4
71.44
2
Cedrusin
346.40
1.8
4
6
99.38
6
14,15,16-Trimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene-11,12-dione
351.40
3.3
0
5
65.07
3
Aspidospermidine-3-carboxylic acid, 2,3-didehydro-1-methyl-, methyl ester, (5alpha,12beta,19alpha)-
352.50
3.6
0
4
32.78
3
Epicoccolide B
358.30
2.4
5
8
148.43
3
Isophilippinolide A
364.60
8.9
1
3
46.53
16
5-[(3R,3aR,6S,6aR)-6-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-1,3-benzodioxole
370.40
2.8
0
6
55.38
4
(3beta,20alpha)-3-Hydroxy-11-oxoolean-12-en-29-oic acid
470.70
6.4
2
4
74.6
1
gerontoxanthone H
380.40
6.3
3
5
90.9
4
(2R,3R,4S,5S,6R)-2-[(1S,2R)-2-hydroxy-4-[(E,3S)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-3-en-1-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
388.50
-1.1
6
8
139.84
5
O-Methylancistrocladinine
419.50
5.2
0
5
49.28
5
(2R,3R)-3-hydroxy-2-phenyl-9-[(E)-3-phenylprop-2-enoyl]-1,5,9-triazacyclotridecan-4-one
421.50
2.4
3
4
81.67
3
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