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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
2-(Methoxymethyl)aniline
137.18
0.9
1
2
35.25
2
hexahydro-1H-pyrrolizine-2-carboxylic acid
155.19
-1.8
1
3
40.54
1
Icosa-2,4-dienamide
307.50
8.1
1
1
43.09
16
4-Ethyl-1-hexene
112.21
3.7
0
0
0
4
Phenyl ethyl 3-methyl butanoate
206.28
3.4
0
2
26.3
5
Butyl methyl ether
88.15
1.7
0
1
9.23
3
Ethyl methyl disulfide
108.23
1.3
0
2
50.6
2
1-Methoxy-4-penta-2,4-diynyl-benzene
170.21
2.8
0
1
9.23
3
Butyl methyl sulfide
104.22
2.1
0
1
25.3
3
2,7-Dimethoxy-9h-carbazole
227.26
3.3
1
2
34.25
2
2-Ethylbenzaldehyde
134.17
2.5
0
1
17.07
2
2-Palmitoylglycerol
330.50
6.1
2
4
66.76
18
2-Methylenebornane
150.26
3.6
0
0
0
0
1,4-Cyclohexadiene
80.13
2.3
0
0
0
0
Methanonaphthalene
140.18
2.3
0
0
0
0
methyl (2Z)-3-(4-hydroxyphenyl)acrylate
178.18
2.3
1
3
46.53
3
5-Methylhexanoic acid
130.18
2.2
1
2
37.3
4
cis-1,1-Dimethylspiro[4,5]decane
166.30
5.4
0
0
0
0
2-Methoxy-4-methyl-1-(prop-1-en-2-yl)benzene
162.23
3.7
0
1
9.23
2
Pentyl acetate
130.18
1.9
0
2
26.3
5
3-Hydroxy-1-(3,5-dimethoxy-4-hydroxyphenyl)-hexan-5-one
268.30
1.2
2
5
75.99
7
2-(Methyldisulfanyl)propane
122.30
1.7
0
2
50.6
2
Pentane-2,3-diol
104.15
0.3
2
2
40.46
2
6,7-Dimethoxy-4-phenylcoumarin
282.29
3
0
4
48.67
3
Methyl 4-hydroxy-2-methylbenzoate
166.17
2.4
1
3
46.53
2
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