In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2006 | 28 | 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) | 4.28 | 10.9 | -16.58 | 1 | 6 | 0 | 65 | 371.396 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 11.34 | -32.73 | 2 | 6 | 1 | 66 | 372.404 | 3 | ↓ |