| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
Popular Name: ethyl 2-({3-nitrobenzoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate ethyl 2-({3-nitrobenzoyl}amino)-…
| 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) | -0.14 | 2.24 | -102.8 | 0 | 8 | -2 | 118 | 326.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.14 | 2.2 | -49.17 | 1 | 8 | -1 | 116 | 327.338 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.14 | 0.22 | -17.16 | 2 | 8 | 0 | 113 | 328.346 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
