In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 24 | 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) | 4.76 | 16.2 | -9.7 | 1 | 6 | 0 | 57 | 324.432 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.76 | 16.63 | -23.18 | 2 | 6 | 1 | 58 | 325.44 | 4 | ↓ |