In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 31 | 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) | 2.83 | 8.73 | -15.32 | 1 | 7 | 0 | 74 | 437.569 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.83 | 11.09 | -46.3 | 2 | 7 | 1 | 76 | 438.577 | 7 | ↓ |