| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 21 | No |
Popular Name: (1E)-N-(4-nitrophenyl)-4-propyl-piperazine-1-carboximidothioic (1E)-N-(4-nitrophenyl)-4-propyl-…
None
| 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) | -1.22 | 10.05 | -56.13 | 2 | 6 | 1 | 65 | 309.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 9.7 | -44.95 | 1 | 6 | 0 | 66 | 308.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
