In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 28 | 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) | 5.15 | 1.42 | -10.91 | 3 | 4 | 0 | 68 | 419.35 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.15 | 1.46 | -35.77 | 4 | 4 | 1 | 69 | 420.358 | 4 | ↓ |