In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 11 | Yes |
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) | 0.80 | 4.1 | -35.8 | 3 | 3 | 1 | 45 | 154.237 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.80 | 4.56 | -92.95 | 4 | 3 | 2 | 47 | 155.245 | 4 | ↓ |