In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 31 | 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) | 2.69 | 7.86 | -13.7 | 1 | 7 | 0 | 73 | 420.513 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 10.03 | -42.54 | 2 | 7 | 1 | 74 | 421.521 | 6 | ↓ |