In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2009 | 38 | Yes |
None
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) | 2.70 | 7.41 | -57.36 | 2 | 10 | -1 | 145 | 517.514 | 12 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 7.26 | -111.58 | 1 | 10 | -2 | 148 | 516.506 | 12 | ↓ |