In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 26 | No |
Popular Name: N-(4-ethoxyphenyl)-4-[(2-fluorophenyl)methyl]piperazine-1-carbothioamide N-(4-ethoxyphenyl)-4-[(2-fluorop…
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) | 3.43 | 9.69 | -12.43 | 1 | 4 | 0 | 28 | 373.497 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 11.89 | -51.38 | 2 | 4 | 1 | 29 | 374.505 | 7 | ↓ |