General Information of the Compound
| Compound ID |
CP0462653
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| Compound Name |
N-[[1-(4-acetylphenyl)indazol-5-yl]methyl]-2-propylpentanamide
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| Structure |
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| Formula |
C24H29N3O2
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| Molecular Weight |
391.515
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| Canonical SMILES |
CCCC(CCC)C(=O)NCc1ccc2n(ncc2c1)-c1ccc(cc1)C(C)=O
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| InChI |
InChI=1S/C24H29N3O2/c1-4-6-20(7-5-2)24(29)25-15-18-8-13-23-21(14-18)16-26-27(23)22-11-9-19(10-12-22)17(3)28/h8-14,16,20H,4-7,15H2,1-3H3,(H,25,29)
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| InChIKey |
DPEPZVLAZVAKBK-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