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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
Myricetin 3'-glucoside
480.40
0
9
13
230.74
4
Cannogenin
388.50
1.3
2
5
83.83
2
Corotoxigenin
388.50
1.3
2
5
83.83
2
Coroglaucigenin
390.50
1.4
3
5
86.99
2
Canophyllal
440.70
8.1
0
2
34.14
1
methyl 6-[3-ethenyl-4-(2-oxoethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carbonyl]oxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate
746.70
-2.5
8
19
286.89
14
Cantleyoside
746.70
-2.5
8
19
286.89
14
(13aR)-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-1-ol
371.40
2.9
1
6
60.39
4
trans-Carane
138.25
3.9
0
0
0
0
6-(11-Hydroxydodecyl)-2-methylpiperidin-3-ol
299.50
4.6
3
3
52.49
11
Cassamedine
349.30
3.2
0
7
76.11
1
Cassameridine
319.30
3.2
0
6
66.88
0
Cassiamin A
522.50
5.5
5
9
169.43
1
1-Epi-castalagin
934.60
0.9
16
26
455.18
0
CID 12302513
934.60
0.9
16
26
455.18
0
(4R,6aS)-1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-4-ol
371.40
2.3
1
6
60.39
4
(2S,4R)-4-hydroxy-2-(3-methylbut-2-enyl)-3,4-dihydro-2H-naphthalen-1-one
230.30
2.9
1
2
37.3
2
Methyl 11-acetyloxy-12-ethyl-8-methyl-20-oxa-8,16-diazahexacyclo[10.6.1.110,13.01,9.02,7.016,19]icosa-2,4,6-triene-10-carboxylate
426.50
2.5
0
7
68.31
5
Cathanneine
426.50
2.5
0
7
68.31
5
Sarmutogenin
404.50
1.2
3
6
104.06
1
Scutellaric acid
472.70
6.8
3
4
77.76
2
4-Epihederagenin
472.70
6.8
3
4
77.76
2
Cedrelopsin
260.28
3.5
1
4
59.67
3
CID 12302594
204.35
4.6
0
0
0
0
Isothankunic acid
504.70
4.3
5
6
118.22
2
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