| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | No |
Popular Name: 2-amino-4-ethyl-5-methyl-N-phenylthiophene-3-carboxamide 2-amino-4-ethyl-5-methyl-N-pheny…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 590353-67-6 , [590353-67-6]
3-Thiophenecarboxamide, 2-amino-4-ethyl-5-methyl-N-phenyl- (9CI)
| 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) | 2.82 | 6.26 | -6.9 | 2 | 3 | 0 | 53 | 260.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 5.31 | -9.19 | 3 | 3 | 0 | 55 | 260.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 6.15 | -13.12 | 2 | 3 | 0 | 53 | 260.362 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
