Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| October 9th, 2009 |
26 |
No
|
Other Names:
3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 6-chloro-1,2-dihydro-17-hydroxy-, (1beta,2beta)-; 3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 6-chloro-1-beta,2-beta-dihydro-17-hydroxy-; 6-Chlor-delta(sup 6)-1,2-alpha-methylen-17-alpha-hydroxypro
Download:
MOL2
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)
|
3.74 |
8.62 |
-12.5 |
1 |
3 |
0 |
54 |
374.908 |
1 |
↓
|
Vendor Notes
| Note Type |
Comments |
Provided By |
| Purity |
99% |
APIChem |
No pre-computed analogs available. Try a structural similarity search.
