In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 26 | 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) | 6.00 | 13.02 | -15.82 | 1 | 3 | 0 | 29 | 349.522 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.00 | 13.45 | -26.68 | 2 | 3 | 1 | 31 | 350.53 | 5 | ↓ |