In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 22 | 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) | 4.83 | 9.2 | -11.32 | 1 | 4 | 0 | 47 | 293.37 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.83 | 9.69 | -25.43 | 2 | 4 | 1 | 48 | 294.378 | 4 | ↓ |