In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 31 | 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) | 3.58 | 5.29 | -15.39 | 1 | 7 | 0 | 80 | 422.529 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 7.39 | -72.14 | 2 | 7 | 1 | 82 | 423.537 | 7 | ↓ |