In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 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) | 3.96 | 11.36 | -9.01 | 0 | 3 | 0 | 42 | 275.355 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.96 | 11.77 | -31.63 | 1 | 3 | 1 | 43 | 276.363 | 4 | ↓ |