General Information of the Compound
| Compound ID |
CP0907726
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| Compound Name |
(S)-1-((S)-2-(2-azidoacetamido)propanoyl)-N-((S)-1-((S)-4-methyl-1-((R)-2-methyloxiran-2-yl)-1-oxopentan-2-ylamino)-1-oxohexan-2-yl)piperidine-2-carboxamide
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| Structure |
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| Formula |
C26H43N7O6
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| Molecular Weight |
549.673
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| Canonical SMILES |
CCCC[C@H](NC(=O)[C@@H]1CCCCN1C(=O)[C@H](C)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1
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| InChI |
InChI=1S/C26H43N7O6/c1-6-7-10-18(23(36)31-19(13-16(2)3)22(35)26(5)15-39-26)30-24(37)20-11-8-9-12-33(20)25(38)17(4)29-21(34)14-28-32-27/h16-20H,6-15H2,1-5H3,(H,29,34)(H,30,37)(H,31,36)/t17-,18-,19-,20-,26+/m0/s1
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| InChIKey |
JRNJQFXVXGPHIB-UVEFFOFDSA-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