General Information of the Compound
| Compound ID |
CP0928336
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| Compound Name |
(R)-3-((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)thiazolidine-4-carboxamide
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| Structure |
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| Formula |
C24H39N7O6S
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| Molecular Weight |
553.686
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| Canonical SMILES |
CCCC[C@H](NC(=O)[C@@H]1CSCN1C(=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/C24H39N7O6S/c1-6-7-8-16(21(34)29-17(9-14(2)3)20(33)24(5)12-37-24)28-22(35)18-11-38-13-31(18)23(36)15(4)27-19(32)10-26-30-25/h14-18H,6-13H2,1-5H3,(H,27,32)(H,28,35)(H,29,34)/t15-,16-,17-,18-,24+/m0/s1
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| InChIKey |
CZGPYWAPYAPRON-BRHFBXIFSA-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