In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | 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) | 0.89 | 4.92 | -6.46 | 2 | 3 | 0 | 46 | 283.169 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 5.22 | -47.92 | 3 | 3 | 1 | 48 | 284.177 | 3 | ↓ |