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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
(1R,4aS,9R,10aR)-9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
316.40
2.8
2
3
57.53
2
Ungiminorine
317.34
-0.6
2
6
71.39
1
cylindol A
318.28
2.4
2
7
102.29
6
[(1R,3S,6S,8R)-8-hydroxy-3-methyl-5-oxo-2,9-dioxatricyclo[4.3.1.03,8]decan-10-yl]methyl benzoate
318.32
0.8
1
6
82.06
4
Pyrido[4,3-b]indolizine-5,7-dione, 8-methoxy-1-(phenylmethyl)-
318.30
2.6
0
5
61.19
3
Niazirinin
321.32
0.5
2
7
109.01
5
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-octaen-17-olate
321.30
3.9
0
4
54.63
1
1,4,5,6-Tetrahydroxy-2-(2-methylbut-3-en-2-yl)xanthen-9-one
328.30
4
4
6
111.13
2
[(E)-5-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-enyl] acetate
332.50
6.4
0
2
26.3
6
phytocassane B
334.40
2.4
3
4
77.76
1
5,7-Dihydroxy-3-[(4-hydroxy-1,3-benzodioxol-5-yl)methyl]-8-methylchromen-4-one
342.30
3.1
3
7
109.36
2
(2R,3S,4S,5R)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenoxy]oxane-3,4,5-triol
342.34
-1.3
5
8
128.84
6
CID 10427700
346.30
1.4
0
7
91.43
8
Methyl 5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylate
346.50
5.2
2
4
66.76
3
1-Naphthalenecarboxylic acid, 5-[2-(2,5-dihydro-2-oxo-3-furanyl)ethyl]decahydro-1,4a-dimethyl-6-methylene-, methyl ester, [1S-(1alpha,4aalpha,5alpha,8abeta)]-; Labda-8(20),13-diene-16,19-dioic acid, 15-hydroxy-, gamma-lactone, methyl ester
346.50
4.5
0
4
52.6
5
(2S)-1-[[(3R,3aS,6E,10E,11aS)-6,10-dimethyl-2-oxo-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-3-yl]methyl]pyrrolidine-2-carboxylic acid
347.40
0.3
1
5
66.84
3
(1R,8R,9S)-3,6-dihydroxy-15-methyl-9-[(1E)-3-methylbuta-1,3-dienyl]tetracyclo[6.5.3.01,9.02,7]hexadeca-2,4,6,11,15-pentaene-10,13-dione
348.40
3
2
4
74.6
2
4-Hydroxy-4-methyltetrahydro-2H-pyran-2-one
130.14
-0.3
1
3
46.53
0
Dipropyl tetrasulfide
214.40
3.6
0
4
101.2
7
(7S,8aS)-5-[[(4S,6S,8R,9aS)-6,8-dimethyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-4-yl]methyl]-7-methyl-3,4,6,7,8,8a-hexahydro-2H-quinoline-1-carbaldehyde
358.60
4.1
0
2
23.55
2
[(3aR,4S,6E,10Z,11aR)-4-acetyloxy-6-formyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-yl]methyl acetate
362.40
1
0
7
95.97
6
[(4S,4aS,5R,8aR,9aS)-9a-hydroxy-3,4a,5-trimethyl-2,6-dioxo-4,5,7,8,8a,9-hexahydrobenzo[f][1]benzofuran-4-yl] (Z)-2-methylbut-2-enoate
362.40
1.8
1
6
89.9
3
(1R,2S,3S,5S,8R,9S,10S,11R,18R)-3,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
364.40
0.3
4
6
107.22
0
Gymnorrhizol
366.60
0.2
3
9
212.49
0
Pteropodine
368.40
1.6
1
5
67.87
2
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