In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | 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) | 2.41 | 10.14 | -20.79 | 0 | 6 | 0 | 57 | 484.572 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 12.36 | -69.15 | 1 | 6 | 1 | 58 | 485.58 | 7 | ↓ |