General Information of the Compound
| Compound ID |
CP0403866
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| Compound Name |
6-chloro-N-[3-[4-[(5R)-3-ethyl-2-oxo-5-phenylimidazolidin-1-yl]piperidin-1-yl]butyl]-2,4-dimethylpyridine-3-carboxamide
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| Structure |
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| Formula |
C28H38ClN5O2
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| Molecular Weight |
512.098
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| Canonical SMILES |
CCN1C[C@H](N(C2CCN(CC2)C(C)CCNC(=O)c2c(C)cc(Cl)nc2C)C1=O)c1ccccc1
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| InChI |
InChI=1S/C28H38ClN5O2/c1-5-32-18-24(22-9-7-6-8-10-22)34(28(32)36)23-12-15-33(16-13-23)20(3)11-14-30-27(35)26-19(2)17-25(29)31-21(26)4/h6-10,17,20,23-24H,5,11-16,18H2,1-4H3,(H,30,35)/t20?,24-/m0/s1
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| InChIKey |
KADVKYIYVIUTGN-JWIMYKKASA-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