Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| June 20th, 2008 |
21 |
Yes
|
Popular Name:
17-hydroxy-13,17-dimethyl-2,3,4,6,7,8,9,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-one
17-hydroxy-13,17-dimethyl-2,3,4,…
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Other Names:
17-hydroxy-13,17-dimethyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-one
A___PH006712
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SDF
SMILES
Flexibase
Physical Representations
|
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
|
Ref
Reference (pH 7)
|
3.29 |
7.58 |
-6.04 |
1 |
2 |
0 |
37 |
288.431 |
0 |
↓
|
No pre-computed analogs available. Try a structural similarity search.
