In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 12 | 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) | -1.43 | 0.02 | -42.27 | 3 | 4 | 1 | 57 | 175.252 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.43 | -1.37 | -11.09 | 2 | 4 | 0 | 53 | 174.244 | 6 | ↓ |