In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2010 | 20 | Yes |
Popular Name: 2-[4-(3-aminothiophene-2-carbonyl)piperazin-1-yl]-N-ethyl-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) | 0.56 | 0.28 | -14.38 | 3 | 6 | 0 | 79 | 296.396 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 2.45 | -43.98 | 4 | 6 | 1 | 80 | 297.404 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.56 | 2.33 | -97.87 | 5 | 6 | 2 | 81 | 298.412 | 4 | ↓ |