| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 20 | No |
Popular Name: N-(3-methylsulfanylpropyl)-4-(3-thienylmethyl)piperazine-1-carbothioamide N-(3-methylsulfanylpropyl)-4-(3-…
| 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) | 2.21 | 7.68 | -11.73 | 1 | 3 | 0 | 19 | 329.56 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 9.91 | -53.29 | 2 | 3 | 1 | 20 | 330.568 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
