| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2010 | 15 | Yes |
Popular Name: 4-Phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine 4-Phenyl-4,5,6,7-tetrahydrothien…
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CAS Number: 66200-59-7
| 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) | 2.75 | 5.66 | -2.7 | 1 | 1 | 0 | 12 | 215.321 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 7.05 | -43.95 | 2 | 1 | 1 | 17 | 216.329 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50597-1-O | Rattus Norvegicus (cluster #1 Of 12), Other | Other | 3000 | 0.52 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50597 | Z50597 | Rattus Norvegicus | 3000 | 0.52 | Functional ≤ 10μM |
