General Information of the Compound
| Compound ID |
CP0163512
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| Compound Name |
1-(1H-indazol-5-yl)-3-(2-phenylethyl)urea
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| Synonyms |
PMID28048944-Compound-19
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| Structure |
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| Formula |
C16H16N4O
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| Molecular Weight |
280.331
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| Canonical SMILES |
O=C(NCCc1ccccc1)Nc1ccc2[nH]ncc2c1
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| InChI |
InChI=1S/C16H16N4O/c21-16(17-9-8-12-4-2-1-3-5-12)19-14-6-7-15-13(10-14)11-18-20-15/h1-7,10-11H,8-9H2,(H,18,20)(H2,17,19,21)
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| InChIKey |
XEZOXLSEWZHMQY-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
Clinical Information about the Compound