In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 30 | 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) | -0.49 | -0.89 | -18.23 | 4 | 12 | 0 | 147 | 421.458 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.49 | 1.37 | -51.07 | 5 | 12 | 1 | 148 | 422.466 | 7 | ↓ |