In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2008 | 23 | No |
Popular Name: N-(3,5-dimethylphenyl)-4-(2-thienylmethyl)piperazine-1-carbothioamide N-(3,5-dimethylphenyl)-4-(2-thie…
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) | 3.61 | 9.86 | -12.59 | 1 | 3 | 0 | 19 | 345.537 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 12.11 | -53.51 | 2 | 3 | 1 | 20 | 346.545 | 5 | ↓ |