In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 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) | 1.54 | 3.44 | -42.39 | 3 | 4 | 1 | 49 | 253.414 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.54 | 4.35 | -107.52 | 4 | 4 | 2 | 50 | 254.422 | 5 | ↓ |