In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 15 | 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) | 1.25 | 3.09 | -35.62 | 2 | 3 | 1 | 29 | 211.329 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 4.74 | -109.38 | 3 | 3 | 2 | 30 | 212.337 | 2 | ↓ |