In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2009 | 21 | 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) | -1.37 | 3.05 | -104.76 | 1 | 8 | -2 | 136 | 315.303 | 8 | ↓ |
Lo Low (pH 4.5-6) | -1.37 | 1.04 | -46.68 | 2 | 8 | -1 | 133 | 316.311 | 8 | ↓ |