General Information of the Compound
| Compound ID |
CP0504356
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| Compound Name |
N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine
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| Structure |
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| Formula |
C14H9Cl3FN5
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| Molecular Weight |
372.618
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| Canonical SMILES |
Fc1ccc(Cl)cc1CNc1nnnn1-c1cccc(Cl)c1Cl
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| InChI |
InChI=1S/C14H9Cl3FN5/c15-9-4-5-11(18)8(6-9)7-19-14-20-21-22-23(14)12-3-1-2-10(16)13(12)17/h1-6H,7H2,(H,19,20,22)
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| InChIKey |
AHRNIFSVDCZWAR-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: PT01449, P2X purinoceptor 7
Protein ID: PT03917, P2X purinoceptor 7