In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 24 | 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) | 2.12 | 13.63 | -19.84 | 0 | 3 | 1 | 20 | 336.484 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.12 | 14.12 | -81.78 | 1 | 3 | 2 | 21 | 337.492 | 3 | ↓ |