In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2009 | 30 | 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) | -0.43 | 7.78 | -69.84 | 0 | 8 | -1 | 95 | 416.429 | 4 | ↓ |
Mid Mid (pH 6-8) | -3.17 | 6.82 | -31.85 | 1 | 8 | 0 | 98 | 417.437 | 3 | ↓ |