General Information of the Compound
| Compound ID |
CP0252231
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| Compound Name |
1-(1,2-benzoxazol-3-yl)-3-[2-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]ethyl]urea
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| Structure |
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| Formula |
C18H16N6O2S
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| Molecular Weight |
380.433
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| Canonical SMILES |
O=C(NCCNc1nc(ns1)-c1ccccc1)Nc1noc2ccccc12
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| InChI |
InChI=1S/C18H16N6O2S/c25-17(21-16-13-8-4-5-9-14(13)26-23-16)19-10-11-20-18-22-15(24-27-18)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,22,24)(H2,19,21,23,25)
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| InChIKey |
OIWOZMKVXYPDAR-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