In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 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) | 2.12 | 6.74 | -91.82 | 4 | 3 | 2 | 45 | 235.375 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 7.32 | -46.66 | 3 | 3 | 1 | 44 | 234.367 | 5 | ↓ |