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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
[(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21S)-4-acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
574.60
0.7
3
11
165.26
5
Telekin
248.32
2.1
1
3
46.53
0
(3aR,4aS,8aR,9aR)-4a-hydroxy-8a-methyl-3,5-dimethylidene-hexahydro-3aH-naphtho[2,3-b]furan-2-one
248.32
2.1
1
3
46.53
0
CID 12443316
680.80
2.2
8
12
214.44
6
(1R)-1-methyl-4-propan-2-ylcyclohex-3-en-1-ol
154.25
2
1
1
20.23
1
(3S,3aR,4aS,5S,8aR,9aR)-3,5,8a-trimethyl-3,3a,4,4a,5,6,7,8,9,9a-decahydrobenzo[f][1]benzofuran-2-one
236.35
4.3
0
2
26.3
0
5,7-Dihydroxy-2-phenyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
432.40
0.9
6
10
170.05
4
(3S,21S)-10,14,15-trimethoxy-4,20-dimethyl-12,28-dioxa-4,20-diazaheptacyclo[27.2.2.17,11.113,17.123,27.03,8.021,35]hexatriaconta-1(32),7(36),8,10,13(35),14,16,23(34),24,26,29(33),30-dodecaen-26-ol
608.70
6.3
1
8
72.86
3
16-Methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene-11,17-diol
338.30
2.2
2
5
72.03
1
(-)-Theaspirone
208.30
1.8
0
2
26.3
0
Calystegine B2
175.18
-2.4
5
5
92.95
0
2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
287.35
2.8
1
4
49.77
5
Methyl 4a-hydroxy-7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
404.40
-2.9
6
11
175.37
6
alpha-THUJENE, (+/-)-
136.23
2.8
0
0
0
1
(1S,4S,5S)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-2-ene
136.23
3.4
0
0
0
1
(1aR,4aS,8aS)-4a,8,8-trimethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene-2-carbaldehyde
218.33
4
0
1
17.07
1
(1R,2E,4S,7Z,11E)-1,7,11-trimethyl-4-propan-2-ylcyclotetradeca-2,7,11-trien-1-ol
290.50
5.1
1
1
20.23
1
(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13R,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,13-diol
442.70
8.5
2
2
40.46
1
Tropigline
223.31
2.5
0
3
29.54
3
(10S,11S)-10,11,16,16-tetramethyl-6-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1,5,7,13,17-pentaene-4,12-dione
368.40
4.2
0
5
65.74
2
Arjugenin
504.70
4.5
5
6
118.22
2
(1R,4aR,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
504.70
4.5
5
6
118.22
2
(3R)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
306.50
4.3
2
2
40.46
5
13-Epitorulosol
306.50
4.3
2
2
40.46
5
5,11-Dihydroxy-3,3-dimethylpyrano[3,2-a]xanthen-12-one
310.30
3.7
2
5
79.9
0
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