| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
Popular Name: ethyl 2-({3-nitro-4-methylbenzoyl}amino)-4,5-dimethyl-3-thiophenecarboxylate ethyl 2-({3-nitro-4-methylbenzoy…
| 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) | 3.74 | 10.36 | -102.06 | 3 | 3 | 2 | 30 | 306.494 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 9.18 | -31.6 | 2 | 3 | 1 | 26 | 305.486 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 8.15 | -38.23 | 2 | 3 | 1 | 29 | 305.486 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
