General Information of the Compound
| Compound ID |
CP0489480
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| Compound Name |
3-[4-(2-methylphenyl)piperazin-1-yl]-N-[(4-phenyl-2-propyl-1,3-oxazol-5-yl)methyl]propan-1-amine
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| Structure |
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| Formula |
C27H36N4O
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| Molecular Weight |
432.612
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| Canonical SMILES |
CCCc1nc(c(CNCCCN2CCN(CC2)c2ccccc2C)o1)-c1ccccc1
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| InChI |
InChI=1S/C27H36N4O/c1-3-10-26-29-27(23-12-5-4-6-13-23)25(32-26)21-28-15-9-16-30-17-19-31(20-18-30)24-14-8-7-11-22(24)2/h4-8,11-14,28H,3,9-10,15-21H2,1-2H3
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| InChIKey |
OFYQVEQPVZJTRF-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