| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2009 | 17 | Yes |
Popular Name: 1-[3-(trifluoromethyl)phenyl]cyclohexan-1-amine hydrochloride 1-[3-(trifluoromethyl)phenyl]cyc…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 125802-22-4 , 125802-23-5
| 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) | 4.17 | 6.7 | -44.46 | 3 | 1 | 1 | 28 | 244.28 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 236 - 238 | Enamine Building Blocks |
| MP | 236...238 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104302-1-O | Glutamate NMDA Receptor (cluster #1 Of 7), Other | Other | 8400 | 0.42 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104302 | Z104302 | Glutamate NMDA Receptor | 8400 | 0.42 | Binding ≤ 10μM |
