In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 32 | No |
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) | 5.60 | 1.03 | -9.97 | 1 | 3 | 0 | 40 | 429.604 | 2 | ↓ |
Ref Reference (pH 7) | 6.34 | 10.12 | -7.55 | 2 | 3 | 0 | 44 | 429.604 | 2 | ↓ |
Lo Low (pH 4.5-6) | 6.34 | 10.89 | -71.38 | 3 | 3 | 0 | 45 | 430.612 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 195 | TCI |
Purity | 99% | APIChem |
Therapy | progesterone antagonist, abortion inducer | SMDC Pharmakon |