In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 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) | 1.92 | 5.3 | -37.37 | 2 | 5 | 1 | 44 | 295.403 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 3.13 | -6.94 | 1 | 5 | 0 | 43 | 294.395 | 9 | ↓ |