In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | 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) | 3.63 | 9.38 | -39.37 | 2 | 3 | 1 | 29 | 285.411 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 7.94 | -4.97 | 1 | 3 | 0 | 24 | 284.403 | 4 | ↓ |