In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | 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) | 1.42 | 8.68 | -46.16 | 1 | 2 | 1 | 28 | 221.349 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 6.36 | -7.72 | 0 | 2 | 0 | 27 | 220.341 | 6 | ↓ |