In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 23 | 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) | 0.84 | 5.34 | -12.17 | 1 | 6 | 0 | 79 | 311.341 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.84 | 5.62 | -41.29 | 2 | 6 | 1 | 81 | 312.349 | 4 | ↓ |