In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 5th, 2010 | 14 | 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) | 1.63 | 4.2 | -4.85 | 0 | 3 | 0 | 19 | 209.318 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 6.44 | -39.45 | 1 | 3 | 1 | 21 | 210.326 | 3 | ↓ |