In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 20 | Yes |
None
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) | 3.56 | 4.96 | -11.68 | 3 | 4 | 0 | 64 | 332.201 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 5.42 | -24.26 | 4 | 4 | 1 | 65 | 333.209 | 2 | ↓ |