| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 21 | No |
Popular Name: N-(3-chloro-4-fluoro-phenyl)-4-isobutyl-piperazine-1-carbothioamide N-(3-chloro-4-fluoro-phenyl)-4-i…
| 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) | 3.38 | 10.47 | -51.49 | 2 | 3 | 1 | 20 | 330.88 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 8.68 | -8.58 | 1 | 3 | 0 | 19 | 329.872 | 5 | ↓ |
