| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2009 | 18 | No |
Popular Name: MFCD01335791 MFCD01335791
Find On: PubMed — Wikipedia — Google
CAS Number: 331987-03-2
2-Amino-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-amino-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| 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) | 2.57 | 3.34 | -11.39 | 3 | 3 | 0 | 67 | 266.41 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.26 | 3.16 | -8.29 | 4 | 3 | 0 | 69 | 266.41 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 3.96 | -4.76 | 3 | 3 | 0 | 67 | 266.41 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
