General Information of the Compound
| Compound ID |
CP0864944
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| Compound Name |
(8S,17S)-8-sec-butyl-17-(3-chlorobenzyl)-6,9,15,18-tetraazaspiro[4.14]nonadecane-7,16,19-trione
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| Structure |
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| Formula |
C26H39ClN4O3
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| Molecular Weight |
491.076
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| Canonical SMILES |
CC[C@H](C)[C@@H]1NCCCCCNC(=O)[C@H](Cc2cccc(Cl)c2)NC(=O)C2(CCCC2)NC1=O
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| InChI |
InChI=1S/C26H39ClN4O3/c1-3-18(2)22-24(33)31-26(12-5-6-13-26)25(34)30-21(17-19-10-9-11-20(27)16-19)23(32)29-15-8-4-7-14-28-22/h9-11,16,18,21-22,28H,3-8,12-15,17H2,1-2H3,(H,29,32)(H,30,34)(H,31,33)/t18-,21-,22-/m0/s1
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| InChIKey |
HRKCMHXCGDBXGV-NYVOZVTQSA-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