In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 27 | No |
Popular Name: N-(3-fluorophenyl)-4-[(2-isopropoxyphenyl)methyl]piperazine-1-carbothioamide N-(3-fluorophenyl)-4-[(2-isoprop…
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 | 10.52 | -10.08 | 1 | 4 | 0 | 28 | 387.524 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 12.76 | -49.53 | 2 | 4 | 1 | 29 | 388.532 | 7 | ↓ |