General Information of the Compound
| Compound ID |
CP0875185
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| Compound Name |
(6R,12S)-6-benzyl-10-methyl-12-propyl-1-oxa-4,7,10,13-tetraazacyclopentadecane-5,8,11-trione
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| Structure |
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| Formula |
C21H32N4O4
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| Molecular Weight |
404.511
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| Canonical SMILES |
CCC[C@@H]1NCCOCCNC(=O)[C@@H](Cc2ccccc2)NC(=O)CN(C)C1=O
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| InChI |
InChI=1S/C21H32N4O4/c1-3-7-17-21(28)25(2)15-19(26)24-18(14-16-8-5-4-6-9-16)20(27)23-11-13-29-12-10-22-17/h4-6,8-9,17-18,22H,3,7,10-15H2,1-2H3,(H,23,27)(H,24,26)/t17-,18+/m0/s1
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| InChIKey |
XNOBIZOSJLAUPZ-ZWKOTPCHSA-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