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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
Phloretin 3',5'-Di-C-glucoside
598.50
-2.3
12
15
278.29
8
CID 10908146
600.90
8.7
3
4
73.22
9
7-hydroxy-3-(7-methoxy-1,3-benzodioxol-5-yl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
622.50
-1.6
7
16
236.43
7
cyclo[Ala-Val-Thr-Pro-Gly-Leu-Ser]
625.70
-0.2
8
9
235.37
5
N1,N5,N10-Tris-trans-p-coumaroylspermine
640.80
4.2
5
7
156.43
18
(E)-Aldosecologanin
758.70
-2.1
8
19
286.89
16
(2s)-3-(Hexadecanoyloxy)-2-[(9z)-Octadec-9-Enoyloxy]propyl 2-(Trimethylammonio)ethyl Phosphate
760.10
13.6
0
8
121
41
Z7Myl7H1AA
138.21
1.3
0
1
17.07
1
2-sulfanyl-1H-indole-3-carbaldehyde
177.22
2
2
2
71.66
1
(1R,3S,5S,7S)-1-ethyl-3,5,7-trimethyl-2,8-dioxabicyclo[3.2.1]octane
184.27
2.5
0
2
18.46
1
2-(5-Fluoro-2,4-dioxopyrimidin-1-yl)acetohydrazide
202.14
-1.9
3
5
109.98
2
Herbertene
202.33
5.5
0
0
0
1
beta-Isocomene
204.35
5.1
0
0
0
0
Viridiflorene
204.35
4
0
0
0
0
3-[(2E,4E,6E)-4,8-dimethylnona-2,4,6-trienyl]furan
216.32
5
0
1
13.14
5
Dodecamethylcyclohexasiloxane
444.92
0
6
55.38
0
2-(2,6-Dihydroxyphenyl)benzene-1,3-diol
218.20
2.1
4
4
80.92
1
2-methylpropyl (2Z)-2-methylbut-2-enoate
156.22
2.9
0
2
26.3
4
1H-Pyrrole-1-butanoic acid, 2-formyl-5-(methoxymethyl)-, methyl ester
239.27
0.3
0
4
57.53
8
(5aS,9aS)-6,6,9a-trimethyl-4,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-1,3-dione
248.32
3.9
0
3
43.37
0
(3S,3aS,5aS,9bR)-3,5a,9-trimethyl-3a,4,6,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2,5-dione
248.32
1.6
0
3
43.37
0
Dendocarbin A
250.33
3.5
1
3
46.53
0
Hexadecamethylheptasiloxane
533.10
0
6
55.38
12
4,8-dimethoxy-3-(3-methylbut-2-enyl)-1H-quinolin-2-one
273.33
2.9
1
3
51.32
4
13-Methoxy-6-methyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-4,7,9(16),10(15),11,13-hexaene-2,3-dione
280.28
2
0
4
52.71
1
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