General Information of the Compound
| Compound ID |
CP0562307
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| Compound Name |
(2R)-N-[4-chloro-3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-2-[(5R,8S)-2,5-dimethyl-5,6,7,8-tetrahydroquinolin-8-yl]propanamide
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| Structure |
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| Formula |
C23H25ClN4O2
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| Molecular Weight |
424.932
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| Canonical SMILES |
C[C@H]([C@@H]1CC[C@@H](C)c2ccc(C)nc12)C(=O)Nc1ccc(Cl)c(c1)-c1noc(C)n1
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| InChI |
InChI=1S/C23H25ClN4O2/c1-12-5-8-18(21-17(12)9-6-13(2)25-21)14(3)23(29)27-16-7-10-20(24)19(11-16)22-26-15(4)30-28-22/h6-7,9-12,14,18H,5,8H2,1-4H3,(H,27,29)/t12-,14-,18+/m1/s1
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| InChIKey |
BUAQQQXCXVROEG-DFHBCGBQSA-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