In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 11 | 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) | -0.07 | 0.45 | -35.84 | 2 | 3 | 1 | 37 | 158.221 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.07 | -1.8 | -5.11 | 1 | 3 | 0 | 36 | 157.213 | 2 | ↓ |