General Information of the Compound
| Compound ID |
CP0557846
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| Compound Name |
2-[(4-bromophenyl)carbamoylamino]-2-cyclopentyl-N-pyrimidin-5-ylacetamide
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| Formula |
C18H20BrN5O2
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| Molecular Weight |
418.295
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| Canonical SMILES |
Brc1ccc(NC(=O)NC(C2CCCC2)C(=O)Nc2cncnc2)cc1
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| InChI |
InChI=1S/C18H20BrN5O2/c19-13-5-7-14(8-6-13)23-18(26)24-16(12-3-1-2-4-12)17(25)22-15-9-20-11-21-10-15/h5-12,16H,1-4H2,(H,22,25)(H2,23,24,26)
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| InChIKey |
LTWLBHGFCQQSTM-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