In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 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) | 0.41 | 4.88 | -7.28 | 2 | 4 | 0 | 66 | 190.25 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 5.35 | -36.33 | 3 | 4 | 1 | 67 | 191.258 | 4 | ↓ |