General Information of the Compound
| Compound ID |
CP0239179
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| Compound Name |
methyl N-[2-(N-[(1S)-1-(2-chlorophenyl)-2-(cyclohexylamino)-2-oxoethyl]-3-fluoroanilino)-2-oxoethyl]carbamate
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| Structure |
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| Formula |
C24H27ClFN3O4
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| Molecular Weight |
475.948
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| Canonical SMILES |
COC(=O)NCC(=O)N([C@H](C(=O)NC1CCCCC1)c1ccccc1Cl)c1cccc(F)c1
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| InChI |
InChI=1S/C24H27ClFN3O4/c1-33-24(32)27-15-21(30)29(18-11-7-8-16(26)14-18)22(19-12-5-6-13-20(19)25)23(31)28-17-9-3-2-4-10-17/h5-8,11-14,17,22H,2-4,9-10,15H2,1H3,(H,27,32)(H,28,31)/t22-/m0/s1
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| InChIKey |
UZZNXVHZUFXIKA-QFIPXVFZSA-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