In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 29 | 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) | 2.75 | 9.33 | -46.34 | 2 | 6 | 1 | 59 | 397.543 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 7.22 | -11.01 | 1 | 6 | 0 | 58 | 396.535 | 7 | ↓ |