In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2008 | 16 | 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) | 1.12 | 2.51 | -15.76 | 3 | 5 | 0 | 85 | 234.284 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 0.21 | -38.06 | 4 | 5 | 1 | 86 | 235.292 | 3 | ↓ |