In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2008 | 20 | 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) | 2.74 | 7.72 | -8.95 | 1 | 6 | 0 | 73 | 276.34 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 8.18 | -39.47 | 2 | 6 | 1 | 74 | 277.348 | 6 | ↓ |