In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | 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) | 0.66 | 4.74 | -12.44 | 0 | 5 | 0 | 57 | 279.384 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 6.92 | -49.13 | 1 | 5 | 1 | 58 | 280.392 | 5 | ↓ |