In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2008 | 34 | 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) | 6.50 | 11.75 | -24.53 | 2 | 6 | 0 | 92 | 491.638 | 7 | ↓ |
Hi High (pH 8-9.5) | 6.95 | 10.49 | -57.75 | 1 | 6 | -1 | 95 | 490.63 | 7 | ↓ |