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 | 1.07 | -9.94 | 1 | 3 | 0 | 40 | 429.604 | 2 | ↓ |
Ref Reference (pH 7) | 6.34 | 10.15 | -7.35 | 2 | 3 | 0 | 44 | 429.604 | 2 | ↓ |
Lo Low (pH 4.5-6) | 6.34 | 10.93 | -71.56 | 3 | 3 | 0 | 45 | 430.612 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Therapy | progesterone antagonist, abortion inducer | SMDC Pharmakon |