In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 28 | 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) | 2.06 | 11.06 | -44.12 | 2 | 4 | 1 | 37 | 374.508 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 8.68 | -7.29 | 1 | 4 | 0 | 36 | 373.5 | 2 | ↓ |