In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 20 | 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) | 2.73 | 5.67 | -5.14 | 0 | 3 | 0 | 22 | 293.432 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 7.87 | -35.12 | 1 | 3 | 1 | 23 | 294.44 | 3 | ↓ |