In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 9th, 2004 | 32 | 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) | 4.93 | 8.49 | -10.61 | 3 | 5 | 0 | 88 | 432.405 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.93 | 8.52 | -61.94 | 4 | 5 | 1 | 89 | 433.413 | 3 | ↓ |