In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2010 | 25 | No |
Popular Name: N-(3-chloro-4-fluoro-phenyl)-4-[(2-fluorophenyl)methyl]piperazine-1-carbothioamide N-(3-chloro-4-fluoro-phenyl)-4-[…
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) | 3.77 | 9.77 | -10.58 | 1 | 3 | 0 | 19 | 381.879 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 11.99 | -52.5 | 2 | 3 | 1 | 20 | 382.887 | 5 | ↓ |