In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
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) | 1.60 | 5.57 | -51.08 | 3 | 2 | 1 | 31 | 251.419 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.60 | 7.29 | -128.87 | 4 | 2 | 2 | 32 | 252.427 | 4 | ↓ |