In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2010 | 34 | 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) | 4.86 | 8.63 | -50.39 | 0 | 7 | -1 | 93 | 475.908 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.40 | 11.3 | -14.31 | 1 | 7 | 0 | 90 | 476.916 | 7 | ↓ |