General Information of the Compound
| Compound ID |
CP0284315
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| Compound Name |
1-(2-Biphenyl-4-yl-4-cyclopentylamino-butyl)-3-(3,5-dichloro-phenyl)-urea
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| Structure |
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| Formula |
C28H31Cl2N3O
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| Molecular Weight |
496.482
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| Canonical SMILES |
Clc1cc(Cl)cc(NC(=O)NCC(CCNC2CCCC2)c2ccc(cc2)-c2ccccc2)c1
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| InChI |
InChI=1S/C28H31Cl2N3O/c29-24-16-25(30)18-27(17-24)33-28(34)32-19-23(14-15-31-26-8-4-5-9-26)22-12-10-21(11-13-22)20-6-2-1-3-7-20/h1-3,6-7,10-13,16-18,23,26,31H,4-5,8-9,14-15,19H2,(H2,32,33,34)
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| InChIKey |
FALDQSPWCQAMAR-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