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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
4-Phenylpyridine
|
155.20
|
2.6
|
0
|
1
|
12.89
|
1
|
|
|
2-Ethylnaphthalene
|
156.22
|
4.4
|
0
|
0
|
0
|
1
|
|
|
(12S,13S)-3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.02,10.04,8.017,21]docosa-1(22),2,4(8),9,15,17(21)-hexaene
|
384.40
|
5
|
0
|
6
|
55.38
|
2
|
|
|
Palustradienol
|
288.50
|
4.6
|
1
|
1
|
20.23
|
2
|
|
|
Methyl maslinate
|
486.70
|
6.8
|
2
|
4
|
66.76
|
2
|
|
|
methyl (4aS,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
486.70
|
6.8
|
2
|
4
|
66.76
|
2
|
|
|
Jacarandic acid
|
488.70
|
5
|
4
|
5
|
97.99
|
1
|
|
|
2-Methyladamantane
|
150.26
|
4.1
|
0
|
0
|
0
|
0
|
|
|
Isopropyl benzoate
|
164.20
|
3.2
|
0
|
2
|
26.3
|
3
|
|
|
Cyclo(L-Pro-L-Ile)
|
210.27
|
1.1
|
1
|
2
|
49.41
|
2
|
|
|
O-methylpisiferic acid
|
330.50
|
5.6
|
1
|
3
|
46.53
|
3
|
|
|
1,3,5-Trimethyladamantane
|
178.31
|
5
|
0
|
0
|
0
|
0
|
|
|
2,3,3-Trimethyl-1,4-pentadiene
|
110.20
|
3.6
|
0
|
0
|
0
|
2
|
|
|
CID 13657696
|
642.60
|
-1.3
|
6
|
16
|
245.04
|
7
|
|
|
4-Methyl-3-penten-1-ol
|
100.16
|
1.5
|
1
|
1
|
20.23
|
2
|
|
|
5-Undecene
|
154.29
|
5.2
|
0
|
0
|
0
|
7
|
|
|
2-Methyl-4-allyl-phenol
|
148.20
|
3
|
1
|
1
|
20.23
|
2
|
|
|
1-Methyladamantane
|
150.26
|
4.2
|
0
|
0
|
0
|
0
|
|
|
1,8-Dimethoxy-3-methylnaphthalene
|
202.25
|
3.5
|
0
|
2
|
18.46
|
2
|
|
|
2,2,4,4,6,6-Hexamethylcyclohexane-1,3,5-trione
|
210.27
|
2.6
|
0
|
3
|
51.21
|
0
|
|
|
2-(Methoxymethoxy)-2-phenylacetaldehyde
|
180.20
|
1.3
|
0
|
3
|
35.53
|
5
|
|
|
1'-Acetonaphthone
|
170.21
|
2.9
|
0
|
1
|
17.07
|
1
|
|
|
6,7-Dimethoxy-1-methyl-3,4-dihydroisoquinolin-8-ol
|
221.25
|
1.2
|
1
|
4
|
51.05
|
2
|
|
|
1-(1,3-Benzodioxol-5-ylmethyl)-7-methoxyisoquinolin-6-ol
|
309.30
|
3.5
|
1
|
5
|
60.81
|
3
|
|
|
4a-Methyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone
|
164.24
|
2.4
|
0
|
1
|
17.07
|
0
|
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