In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 26 | No |
Popular Name: N-(2,5-dimethylphenyl)-4-[(4-ethylphenyl)methyl]piperazine-1-carbothioamide N-(2,5-dimethylphenyl)-4-[(4-eth…
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) | 4.62 | 12.15 | -10.06 | 1 | 3 | 0 | 19 | 367.562 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 14.37 | -51.36 | 2 | 3 | 1 | 20 | 368.57 | 6 | ↓ |