In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 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) | 0.84 | 10.74 | -87.92 | 1 | 6 | 0 | 70 | 417.456 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.91 | 9.79 | -63.03 | 2 | 6 | 1 | 73 | 418.464 | 3 | ↓ |