In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 36 | 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) | 5.58 | 12.43 | -37.18 | 3 | 6 | 1 | 68 | 482.604 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.58 | 10.38 | -14.41 | 2 | 6 | 0 | 67 | 481.596 | 6 | ↓ |