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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
(2R,3R,4S,5S,6R)-2-hex-3-enoxy-6-(hydroxymethyl)oxane-3,4,5-triol
262.30
-0.4
4
6
99.38
6
Cyclamiretin C
472.70
5.3
3
4
69.92
0
3,12-Dihydroxyhexadecanoic acid
288.42
3.9
3
4
77.76
14
1,3-Nonadiene
124.22
4.1
0
0
0
5
Precocene II
220.26
3.3
0
3
27.69
2
4-Methylbiphenyl
168.23
4.6
0
0
0
1
Citronensauredimethylester
220.18
-1.1
2
7
110.13
7
3-Hydroxy-3-(methoxycarbonyl)pentanedioic acid
206.15
-1.4
3
7
121.13
6
Methyl epijasmonate
224.30
1.9
0
3
43.37
6
2-Propylphenol
136.19
2.9
1
1
20.23
2
3,5,5-Trimethyl-2,5-dihydro-1-pyrrol-2-one
125.17
0.6
1
1
29.1
0
Propyl isobutyrate
130.18
2.1
0
2
26.3
4
Neryl hexanoate
252.39
5.4
0
2
26.3
10
(+)-p-Menta-1-en-9-ol
154.25
2.2
1
1
20.23
2
2alpha-Hydroxyalantolactone
248.32
2.2
1
3
46.53
0
3-Hydroxy-4-methoxybenzoic acid
168.15
1.4
2
4
66.76
2
Pipercitine
349.60
8.9
0
1
20.31
15
(R)-2-Amino-3-(3-hydroxy-4-oxopyridin-1(4H)-yl)propanoic acid
198.18
-3.5
3
6
105.55
3
(E)-hex-4-en-2-ol
100.16
1.3
1
1
20.23
2
Canavalmine
216.37
-0.7
4
4
76.1
12
4'-Isopropylacetophenone
162.23
3
0
1
17.07
2
(7E,10E)-hexadeca-7,10-dienal
236.39
5.4
0
1
17.07
12
4-Propylphenol
136.19
3.2
1
1
20.23
2
Benzenepropanenitrile
131.17
1.7
0
1
23.79
2
CID 12582
126.20
2.3
0
1
17.07
4
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