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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
Speciogynine
398.50
3.4
1
5
63.79
6
methyl (Z)-2-[(2S,3S,12bS)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
398.50
3.4
1
5
63.79
6
Monoginol A
444.70
8.4
2
2
40.46
1
1-Stearoyl-sn-glycerol
358.60
7.4
2
4
66.76
20
3-Stearoyl-sn-glycerol
358.60
7.4
2
4
66.76
20
Mopanin
298.25
1.9
3
6
100.13
0
CID 15560614
302.28
0.8
4
6
99.38
0
17beta(H),21beta(H)-HOP-22(29)-EN-3-ONE
424.70
9.6
0
1
17.07
1
Quinoline-3-carboxamide
172.18
1.1
1
2
55.98
1
alpha-Linolenoyl phenylethylamine
381.60
7.6
1
1
29.1
16
P-Mentha-2,8-dien-1-ol
152.23
2.4
1
1
20.23
1
Steporphine
295.30
2.2
1
4
41.93
0
(4R)-4-hydroxy-5,5-dimethyloxolan-2-one
130.14
-0.2
1
3
46.53
0
9-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one
338.40
5.3
0
4
52.58
6
4-[(2S,3S)-3-tetradeca-1,3,5,8-tetraenyloxiran-2-yl]butanoic acid
318.40
5.3
1
3
49.83
13
Spinosin
608.50
-1.1
9
15
249.2
7
8-Hydroxyhexadecanoic acid
272.42
5.4
2
3
57.53
14
(8R)-8-hydroxyhexadecanoic acid
272.42
5.4
2
3
57.53
14
(R)-beta-hydroxypalmitic acid
272.42
5.8
2
3
57.53
14
2,5-Dihydrofuran
70.09
0.5
0
1
9.23
0
(3S,7S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2S)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
402.70
7.4
2
2
40.46
5
Diacetoxyscirpenol
366.40
0.2
1
7
94.59
5
Scirpene-3,4,15-triol
282.33
-1
3
5
82.45
1
11-Hydroxytephrosin
426.40
3.2
2
8
103.68
2
4-Hydroxy-9h-pyrido[3,4-b]indole-1-carboxylic acid methyl ester
242.23
2.1
2
4
75.21
2
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