In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2009 | 24 | 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) | 4.03 | 10.02 | -4.84 | 0 | 2 | 0 | 12 | 319.448 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 12.3 | -39.91 | 1 | 2 | 1 | 14 | 320.456 | 3 | ↓ |