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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
CID 137796431
792.90
3.1
2
14
178.04
12
CID 137796432
1079.20
-2.9
14
24
383.36
16
Gnetumontanin B
712.70
7
9
11
200.53
6
CID 137796503
340.40
1.8
3
4
76.56
1
CID 137796515
498.60
5.4
1
6
89.9
8
7,8-Dihydroxy-4,9,13-trimethyl-6-oxatetracyclo[7.4.0.03,7.010,12]trideca-1(13),3-dien-5-one
262.30
0.1
2
4
66.76
0
2-[2-[3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one
570.50
-1.8
7
14
217.97
7
Erioside
356.28
-1
6
10
170.05
3
(3,4-Dihydroxyphenyl) acetate
168.15
1.6
2
4
66.76
2
cyclo(L-Phe-L-Val)
246.30
2
2
2
58.2
3
(3S,6S)-3-Isopropyl-6-methylpiperazine-2,5-dione
170.21
0.5
2
2
58.2
1
Isopimara-8,15-diene
272.50
6.5
0
0
0
1
Pimara-8,15-diene
272.50
6.5
0
0
0
1
Stigmasta-3,5-diene
396.70
10.6
0
0
0
6
6-[(3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
564.50
-1.6
10
14
250.97
5
Glycerol 1,3-dihexadecanoate 2-(9Z,12Z-octadecadienoate)
831.30
21.4
0
6
78.9
50
1,3-Dipalmitoyl-2-linoleoylglycerol
831.30
21.4
0
6
78.9
50
Gnetifolin E
420.40
0.5
6
9
149.07
6
trans-p-Coumaric acid 4-glucoside
326.30
0.1
5
8
136.68
5
(4R,15S,16S,18R)-15-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-5,7,9,11-tetraen-4-ol
312.40
1.6
1
4
48.36
1
19,20-(E)-Vallesamine
340.40
1.3
2
4
65.56
3
methyl (12S,13S,14Z)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate
340.40
1.3
2
4
65.56
3
16-Hydroxy-16,22-dihydroapparicine
282.40
1.7
2
2
39.26
0
Ethanone, 1-(2-methyl-1-cyclopenten-1-yl)-
124.18
1.2
0
1
17.07
1
(+)-Pisiferal
300.40
5.2
1
2
37.3
2
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