General Information of the Compound
| Compound ID |
CP0876283
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| Compound Name |
(S)-1-(4-bromophenyl)-3-(1-(indolin-1-yl)-1-oxo-3-phenylpropan-2-yl)urea
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| Structure |
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| Formula |
C24H22BrN3O2
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| Molecular Weight |
464.363
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| Canonical SMILES |
O=C(Nc1ccc(Br)cc1)N[C@@H](Cc1ccccc1)C(=O)N1CCc2ccccc21
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| InChI |
InChI=1S/C24H22BrN3O2/c25-19-10-12-20(13-11-19)26-24(30)27-21(16-17-6-2-1-3-7-17)23(29)28-15-14-18-8-4-5-9-22(18)28/h1-13,21H,14-16H2,(H2,26,27,30)/t21-/m0/s1
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| InChIKey |
OAYMQFJNPZZONM-NRFANRHFSA-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