In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 34 | 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) | 0.98 | 3.08 | -62.09 | 3 | 8 | 1 | 88 | 485.527 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 5.51 | -116.44 | 4 | 8 | 2 | 89 | 486.535 | 6 | ↓ |