| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 21 | Yes |
Popular Name: 2-[4-(3-aminothiophene-2-carbonyl)piperazin-1-yl]-N-propyl-acetamide 2-[4-(3-aminothiophene-2-carbony…
| 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) | 1.06 | 1.04 | -14.32 | 3 | 6 | 0 | 79 | 310.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 3.21 | -44.28 | 4 | 6 | 1 | 80 | 311.431 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | 3.09 | -98.36 | 5 | 6 | 2 | 81 | 312.439 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
