In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | 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) | 1.57 | 3.37 | -5.49 | 0 | 3 | 0 | 30 | 211.305 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 5.21 | -29.92 | 1 | 3 | 1 | 31 | 212.313 | 1 | ↓ |