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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
Stemar-13-ene
272.50
6.7
0
0
0
0
7-Hydroxy-9H-carbazole-3-carbaldehyde
211.22
2.5
2
2
53.09
1
N-methoxy-3-hydroxymethylcarbazole
227.26
2.9
1
2
34.39
2
1-methoxy-9-[(1-methoxy-9H-carbazol-3-yl)methyl]carbazole-3-carbaldehyde
434.50
5.8
1
3
56.25
5
(6Z)-6-[[6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl]methylidene]-[1,3]dioxolo[4,5-g]isoindol-8-one
380.40
2.8
1
6
69.26
4
(1R,13S,24S)-12-methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-2,4(8),9,14,16(20),21-hexaen-24-ol
353.40
2.2
1
6
60.39
0
(+)-Simalikalactone
478.50
0.6
3
9
139.59
4
Morindin
564.50
-0.6
8
14
232.9
5
Cyclododecene
166.30
5.7
0
0
0
0
1-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]pyrrolidin-2-one
245.27
1.6
0
3
46.61
3
Cyclodecanol
156.26
2.7
1
1
20.23
0
Isouvaretin
378.40
4.9
3
5
86.99
7
L-Alanine, L-I(3)-glutamyl-3-(5-oxo-2(5H)-isoxazolyl)-
301.25
-3.9
4
9
164.86
8
(2S)-2-amino-5-oxo-5-[2-(5-oxo-1,2-oxazol-2-yl)ethylamino]pentanoic acid
257.24
-3.5
3
7
127.56
7
3-Buten-2-ol, 4-phenyl-
148.20
2.1
1
1
20.23
2
[(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 4-(2-hydroxypropan-2-yl)cyclohexene-1-carboxylate
614.60
2.1
7
13
216.58
8
3,4-Dihydroxymandelaldehyde
168.15
-0.6
3
4
77.76
2
6,8-Dihydroxy-1,1,7-tris(3-methylbut-2-enyl)-3,4-dihydroxanthene-2,9-dione
450.60
6.8
2
5
87.74
6
1-(2,4,5-Trimethoxyphenyl)-1,2-propanedione
238.24
1.2
0
5
61.83
5
3-(2-Methoxyphenyl)acrylaldehyde
162.18
1.7
0
2
26.3
3
5-Hydroxypiperidine-2-carboxylic acid
145.16
-3
3
4
69.56
1
5,6-Dehydroeurycomalactone
346.40
0.1
2
6
100.9
0
Octadec-13-enoic acid
282.50
7.2
1
2
37.3
15
(3S,4R,4aR,6aR,6bS,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-2,3,4a,5,6,7,8,9,10,12,14,14a-dodecahydro-1H-picen-3-ol
426.70
6.8
2
2
40.46
1
Aranciamycin
544.50
0.3
5
12
189.28
4
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