In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 33 | 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) | 3.25 | 12.42 | -74 | 1 | 7 | 0 | 82 | 446.551 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 11.6 | -51.07 | 2 | 7 | 1 | 79 | 447.559 | 9 | ↓ |