In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 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) | 0.82 | 0.58 | -10.91 | 3 | 5 | 0 | 68 | 328.21 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 2.85 | -46.16 | 4 | 5 | 1 | 69 | 329.218 | 4 | ↓ |