In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 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) | 2.48 | 5.65 | -42.34 | 3 | 2 | 1 | 31 | 233.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 7.59 | -106.45 | 4 | 2 | 2 | 32 | 234.387 | 3 | ↓ |