In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 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) | 3.43 | 10.39 | -23.05 | 1 | 11 | 0 | 148 | 455.452 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.43 | 11.34 | -49.12 | 2 | 11 | 1 | 150 | 456.46 | 5 | ↓ |