In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 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) | 1.24 | 0.95 | -41.36 | 4 | 3 | 1 | 60 | 250.141 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.24 | -0.36 | -9.56 | 3 | 3 | 0 | 55 | 249.133 | 3 | ↓ |