In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 22 | 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) | 4.81 | 11.69 | -42.46 | 1 | 2 | 1 | 17 | 315.506 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.81 | 12.07 | -74.25 | 2 | 2 | 2 | 19 | 316.514 | 5 | ↓ |