In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 28 | 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) | 4.06 | 10.02 | -7.87 | 1 | 4 | 0 | 56 | 405.548 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.06 | 12.28 | -46.58 | 2 | 4 | 1 | 57 | 406.556 | 5 | ↓ |