In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 38 | 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) | 6.22 | 14.19 | -10.3 | 1 | 5 | 0 | 53 | 529.75 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.22 | 16.41 | -51.03 | 2 | 5 | 1 | 54 | 530.758 | 6 | ↓ |