General Information of the Compound
| Compound ID |
CP0546550
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| Compound Name |
N-[2-[4-(3,5-difluorophenyl)piperazin-1-yl]ethyl]naphthalene-2-carboxamide
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| Structure |
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| Formula |
C23H23F2N3O
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| Molecular Weight |
395.453
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| Canonical SMILES |
Fc1cc(F)cc(c1)N1CCN(CCNC(=O)c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C23H23F2N3O/c24-20-14-21(25)16-22(15-20)28-11-9-27(10-12-28)8-7-26-23(29)19-6-5-17-3-1-2-4-18(17)13-19/h1-6,13-16H,7-12H2,(H,26,29)
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| InChIKey |
LAVBCIVPPLNEIC-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound