General Information of the Compound
| Compound ID |
CP0578433
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| Compound Name |
2-[(4-bromophenyl)carbamoylamino]-2-cyclopentyl-N-(oxolan-2-ylmethyl)acetamide
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| Formula |
C19H26BrN3O3
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| Molecular Weight |
424.339
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| Canonical SMILES |
Brc1ccc(NC(=O)NC(C2CCCC2)C(=O)NCC2CCCO2)cc1
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| InChI |
InChI=1S/C19H26BrN3O3/c20-14-7-9-15(10-8-14)22-19(25)23-17(13-4-1-2-5-13)18(24)21-12-16-6-3-11-26-16/h7-10,13,16-17H,1-6,11-12H2,(H,21,24)(H2,22,23,25)
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| InChIKey |
JDGUPLBUZUNGHY-UHFFFAOYSA-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