General Information of the Compound
| Compound ID |
CP0374850
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| Compound Name |
1-m-Tolyl-[1,2,4]triazinan-3-one
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| Structure |
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| Formula |
C10H13N3O
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| Molecular Weight |
191.234
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| Canonical SMILES |
Cc1cccc(c1)N1CCNC(=O)N1
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| InChI |
InChI=1S/C10H13N3O/c1-8-3-2-4-9(7-8)13-6-5-11-10(14)12-13/h2-4,7H,5-6H2,1H3,(H2,11,12,14)
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| InChIKey |
ARWMEQVLMJCDKV-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