In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2009 | 32 | Yes |
Popular Name: 4-(3,3-diphenylpropyl)-1-(3-(4-methoxyphenyl)propyl)piperidine hydrochloride 4-(3,3-diphenylpropyl)-1-(3-(4-m…
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CAS Number: 136647-02-4
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) | 7.41 | 18.23 | -41.91 | 1 | 2 | 1 | 14 | 428.64 | 10 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z81047-1-O | Human T-cell Line (cluster #1 Of 2), Other | Other | 200 | 0.29 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z81047 | Z81047 | Human T-cell Line | 200 | 0.29 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.