In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: (3-amino-4-fluoro-phenyl)-(4-benzylpiperazin-1-yl)methanone (3-amino-4-fluoro-phenyl)-(4-ben…
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) | 1.77 | 5.34 | -9.46 | 2 | 4 | 0 | 50 | 313.376 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 7.67 | -49.97 | 3 | 4 | 1 | 51 | 314.384 | 3 | ↓ |