General Information of the Compound
| Compound ID |
CP0571873
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| Compound Name |
(2R)-N-[(2R)-6-amino-1-morpholin-4-yl-1-oxohexan-2-yl]-4-methyl-2-[[(2R)-3-phenyl-2-[[2-(3-phenylpropylamino)acetyl]amino]propanoyl]amino]pentanamide
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| Formula |
C36H54N6O5
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| Molecular Weight |
650.865
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| Canonical SMILES |
CC(C)C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)CNCCCc1ccccc1)C(=O)N[C@H](CCCCN)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C36H54N6O5/c1-27(2)24-31(34(44)40-30(17-9-10-18-37)36(46)42-20-22-47-23-21-42)41-35(45)32(25-29-14-7-4-8-15-29)39-33(43)26-38-19-11-16-28-12-5-3-6-13-28/h3-8,12-15,27,30-32,38H,9-11,16-26,37H2,1-2H3,(H,39,43)(H,40,44)(H,41,45)/t30-,31-,32-/m1/s1
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| InChIKey |
NYBPFTQDXXYNJM-XWHIBYANSA-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