General Information of the Compound
| Compound ID |
CP0490498
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| Compound Name |
1-[2-(3,4-Dichloro-phenyl)-ethyl]-3-(7-hydroxy-naphthalen-1-yl)-urea
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| Structure |
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| Formula |
C19H16Cl2N2O2
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| Molecular Weight |
375.255
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| Canonical SMILES |
Oc1ccc2cccc(NC(=O)NCCc3ccc(Cl)c(Cl)c3)c2c1
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| InChI |
InChI=1S/C19H16Cl2N2O2/c20-16-7-4-12(10-17(16)21)8-9-22-19(25)23-18-3-1-2-13-5-6-14(24)11-15(13)18/h1-7,10-11,24H,8-9H2,(H2,22,23,25)
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| InChIKey |
FMNOTFXDWPTZQN-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