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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
cis,cis-Farnesol
222.37
4.8
1
1
20.23
7
Dihydroechioidinin
286.28
2.7
2
5
75.99
2
(2Z,6E)-Farnesol
222.37
4.8
1
1
20.23
7
6-Geranylgeranyl 8'-methyl 6,8'-diapocarotene-6,8'-dioate
640.90
14
0
4
52.6
22
1-O-methyl 20-O-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl] (2E,4E,6E,8E,10E,12E,14E,16E,18E)-4,8,13,17-tetramethylicosa-2,4,6,8,10,12,14,16,18-nonaenedioate
667.00
14.9
0
4
52.6
23
(E,Z)-farnesol
222.37
4.8
1
1
20.23
7
cis-Caffeic acid
180.16
1.2
3
4
77.76
2
Sagecoumarin
536.40
3.7
6
12
204.19
9
(2S)-5-(diaminomethylideneazaniumyl)-2-(phenylmethoxycarbonylamino)pentanoate
308.33
0.9
4
4
144.47
8
4,8-Dimethoxy-1-methyl-3-(3-methylbut-2-en-1-yl)quinolin-2(1H)-one
287.35
3.1
0
3
40.46
4
(2S,3S)-3,5,7-trihydroxy-2-[(2S,3S)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one
482.40
2.4
5
10
155.14
4
3,5-Dihydroxy-1,2-dimethoxy-9h-xanthen-9-one
288.25
2.2
2
6
89.13
2
4-Methoxy-3-undecylbenzene-1,2-diol
294.40
6.9
2
3
49.69
11
1,3,7-Trihydroxy-5,6-dimethoxy-9h-xanthen-9-one
304.25
2.4
3
7
109.36
2
(17R)-13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde
386.30
2.2
2
9
128.59
2
(2R)-2-methyl-2-(4-methylpent-3-enyl)-7-propylchromen-5-ol
286.40
5.8
1
2
29.46
5
(2S)-2-(2-azaniumylacetamido)-3-phenylpropanoate
222.24
-1.9
2
3
96.87
4
4-(2-Furanyl)-3-buten-2-one
136.15
1.4
0
2
30.21
2
2-[(E)-hydroxyiminomethyl]-N-[(1S)-2-hydroxy-1-[(4S)-4-(3-methoxy-5-oxo-2H-pyrrole-1-carbonyl)-4,5-dihydro-1,3-thiazol-2-yl]ethyl]-1,3-thiazole-4-carboxamide
439.50
-0.6
3
11
207.32
7
(R)-2-methyl-3-phenylpropanal
148.20
2.2
0
1
17.07
3
Geranylacetone
194.31
3.7
0
1
17.07
6
Tabex (TN)
190.24
0.2
1
2
34.03
0
Amiloxate
248.32
3.9
0
3
35.53
7
Tigliane
274.50
7.1
0
0
0
0
Bisabolol
222.37
3.8
1
1
20.23
4
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