In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 32 | 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) | 5.32 | 11.84 | -46.08 | 3 | 5 | 1 | 59 | 430.503 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.32 | 10.13 | -11.81 | 2 | 5 | 0 | 57 | 429.495 | 5 | ↓ |