In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 17 | 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) | 4.22 | 8.74 | -7.59 | 0 | 2 | 0 | 18 | 230.355 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 9.29 | -23.66 | 1 | 2 | 1 | 19 | 231.363 | 3 | ↓ |