In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 18 | 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) | 1.65 | 5.9 | -44.51 | 5 | 2 | 1 | 54 | 241.358 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 6.2 | -142.89 | 6 | 2 | 2 | 55 | 242.366 | 5 | ↓ |