General Information of the Compound
| Compound ID |
CP0489476
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| Compound Name |
2-(4-(3-chlorophenyl)piperazin-1-yl)-N-((4-phenyl-2-propyloxazol-5-yl)methyl)ethanamine
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| Structure |
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| Formula |
C25H31ClN4O
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| Molecular Weight |
439.003
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| Canonical SMILES |
CCCc1nc(c(CNCCN2CCN(CC2)c2cccc(Cl)c2)o1)-c1ccccc1
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| InChI |
InChI=1S/C25H31ClN4O/c1-2-7-24-28-25(20-8-4-3-5-9-20)23(31-24)19-27-12-13-29-14-16-30(17-15-29)22-11-6-10-21(26)18-22/h3-6,8-11,18,27H,2,7,12-17,19H2,1H3
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| InChIKey |
WCNBFWWJRUYDFG-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