In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2010 | 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) | 2.74 | 6.7 | -33.8 | 2 | 2 | 1 | 29 | 233.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.58 | -5.12 | 1 | 2 | 0 | 25 | 232.352 | 4 | ↓ |