In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 27 | 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) | 3.39 | 9.97 | -40.13 | 1 | 4 | 1 | 30 | 373.492 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 9.53 | -47.78 | 1 | 4 | 1 | 30 | 373.492 | 6 | ↓ |