In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 19 | 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) | 2.63 | 5.93 | -44.85 | 2 | 3 | 1 | 29 | 263.405 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.63 | 8.28 | -125.11 | 3 | 3 | 2 | 30 | 264.413 | 7 | ↓ |