General Information of the Compound
| Compound ID |
CP0477993
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| Compound Name |
[4-[6-chloro-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)quinoline-3-carbonyl]piperazin-1-yl]-cyclopropylmethanone
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| Structure |
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| Formula |
C25H29ClN4O4
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| Molecular Weight |
484.984
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| Canonical SMILES |
Clc1ccc2ncc(C(=O)N3CCN(CC3)C(=O)C3CC3)c(N3CCC4(CC3)OCCO4)c2c1
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| InChI |
InChI=1S/C25H29ClN4O4/c26-18-3-4-21-19(15-18)22(28-7-5-25(6-8-28)33-13-14-34-25)20(16-27-21)24(32)30-11-9-29(10-12-30)23(31)17-1-2-17/h3-4,15-17H,1-2,5-14H2
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| InChIKey |
ALEOSAXDAUEICY-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