In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | 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) | 2.63 | 4.65 | -7.67 | 0 | 3 | 0 | 36 | 234.343 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 6.72 | -40.11 | 1 | 3 | 1 | 37 | 235.351 | 1 | ↓ |