General Information of the Compound
| Compound ID |
CP0457378
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| Compound Name |
tert-butyl N-[(2R)-1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-2-methyl-1-oxo-3-phenylpropan-2-yl]carbamate
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| Structure |
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| Formula |
C24H31N3O4
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| Molecular Weight |
425.529
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@](C)(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(N)=O
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| InChI |
InChI=1S/C24H31N3O4/c1-23(2,3)31-22(30)27-24(4,16-18-13-9-6-10-14-18)21(29)26-19(20(25)28)15-17-11-7-5-8-12-17/h5-14,19H,15-16H2,1-4H3,(H2,25,28)(H,26,29)(H,27,30)/t19?,24-/m1/s1
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| InChIKey |
YWNMWDMPRXDQSP-JKSFWZLDSA-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