In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2010 | 12 | 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) | 0.36 | 1.93 | -24.41 | 1 | 5 | 0 | 79 | 182.208 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 0.63 | -42.41 | 0 | 5 | -1 | 85 | 181.2 | 2 | ↓ |