General Information of the Compound
| Compound ID |
CP0471405
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| Compound Name |
[5-(1-methylindol-4-yl)-1,3,4-oxadiazol-2-yl]-[4-[(4-methylphenyl)methyl]piperazin-1-yl]methanone
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| Formula |
C24H25N5O2
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| Molecular Weight |
415.497
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| Canonical SMILES |
Cc1ccc(CN2CCN(CC2)C(=O)c2nnc(o2)-c2cccc3n(C)ccc23)cc1
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| InChI |
InChI=1S/C24H25N5O2/c1-17-6-8-18(9-7-17)16-28-12-14-29(15-13-28)24(30)23-26-25-22(31-23)20-4-3-5-21-19(20)10-11-27(21)2/h3-11H,12-16H2,1-2H3
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| InChIKey |
CVLMNKCALXCMJE-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