| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | No |
Popular Name: 2-amino-6-ethyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 2-amino-6-ethyl-N-phenyl-4,5,6,7…
Find On: PubMed — Wikipedia — Google
CAS Number: 590353-68-7
| 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) | 3.67 | 7.94 | -6.25 | 2 | 3 | 0 | 53 | 300.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 7.14 | -8.83 | 3 | 3 | 0 | 55 | 300.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | 7.3 | -11.53 | 2 | 3 | 0 | 53 | 300.427 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
