In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 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) | -1.53 | 1.71 | -77.69 | 3 | 6 | 0 | 95 | 216.237 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.53 | 0.36 | -47.72 | 2 | 6 | -1 | 90 | 215.229 | 5 | ↓ |