General Information of the Compound
| Compound ID |
CP0414345
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| Compound Name |
N-[(1R)-1-cyclohexyl-2-(1-cyclopropyl-3-methyl-4-oxo-1,3,8-triazaspiro[4.5]decan-8-yl)-2-oxoethyl]-2-fluoro-3-methylbenzamide
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| Structure |
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| Formula |
C27H37FN4O3
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| Molecular Weight |
484.616
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| Canonical SMILES |
CN1CN(C2CC2)C2(CCN(CC2)C(=O)[C@H](NC(=O)c2cccc(C)c2F)C2CCCCC2)C1=O
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| InChI |
InChI=1S/C27H37FN4O3/c1-18-7-6-10-21(22(18)28)24(33)29-23(19-8-4-3-5-9-19)25(34)31-15-13-27(14-16-31)26(35)30(2)17-32(27)20-11-12-20/h6-7,10,19-20,23H,3-5,8-9,11-17H2,1-2H3,(H,29,33)/t23-/m1/s1
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| InChIKey |
ICIKUEFVFYGEAN-HSZRJFAPSA-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