In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 19 | 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) | 2.78 | 8.21 | -6.37 | 0 | 4 | 0 | 38 | 257.337 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 8.68 | -30.43 | 1 | 4 | 1 | 40 | 258.345 | 1 | ↓ |