In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | 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) | 2.85 | 7.09 | -31.29 | 2 | 3 | 1 | 26 | 265.421 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 8 | -112.68 | 3 | 3 | 2 | 30 | 266.429 | 7 | ↓ |