General Information of the Compound
| Compound ID |
CP0476848
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| Compound Name |
1-(7-hydroxynaphthalen-1-yl)-3-(3-nitrophenyl)urea
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| Structure |
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| Formula |
C17H13N3O4
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| Molecular Weight |
323.308
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| Canonical SMILES |
Oc1ccc2cccc(NC(=O)Nc3cccc(c3)[N+]([O-])=O)c2c1
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| InChI |
InChI=1S/C17H13N3O4/c21-14-8-7-11-3-1-6-16(15(11)10-14)19-17(22)18-12-4-2-5-13(9-12)20(23)24/h1-10,21H,(H2,18,19,22)
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| InChIKey |
DLVDOCMHOHXYPN-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
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1