In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 20 | 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) | 1.47 | 8.95 | -14.11 | 0 | 5 | 0 | 57 | 269.304 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 9.46 | -46.92 | 1 | 5 | 1 | 58 | 270.312 | 4 | ↓ |