General Information of the Compound
| Compound ID |
CP0903689
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| Compound Name |
(8S,20S)-8-sec-butyl-20-(3-chlorobenzyl)-12,15-dioxa-6,9,18,21-tetraazaspiro[4.17]docosane-7,19,22-trione
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| Structure |
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| Formula |
C27H41ClN4O5
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| Molecular Weight |
537.101
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| Canonical SMILES |
CC[C@H](C)[C@@H]1NCCOCCOCCNC(=O)[C@H](Cc2cccc(Cl)c2)NC(=O)C2(CCCC2)NC1=O
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| InChI |
InChI=1S/C27H41ClN4O5/c1-3-19(2)23-25(34)32-27(9-4-5-10-27)26(35)31-22(18-20-7-6-8-21(28)17-20)24(33)30-12-14-37-16-15-36-13-11-29-23/h6-8,17,19,22-23,29H,3-5,9-16,18H2,1-2H3,(H,30,33)(H,31,35)(H,32,34)/t19-,22-,23-/m0/s1
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| InChIKey |
UVIKCHICDASBIX-VJBMBRPKSA-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