General Information of the Compound
| Compound ID |
CP0960309
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| Compound Name |
(R)-5-((4'-(2-(2-methylpyrrolidin-1-yl)ethyl)biphenyl-4-yl)methyl)-1H-tetrazole
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| Structure |
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| Formula |
C21H25N5
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| Molecular Weight |
347.466
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc(-c2ccc(Cc3nnn[nH]3)cc2)cc1
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| InChI |
InChI=1S/C21H25N5/c1-16-3-2-13-26(16)14-12-17-4-8-19(9-5-17)20-10-6-18(7-11-20)15-21-22-24-25-23-21/h4-11,16H,2-3,12-15H2,1H3,(H,22,23,24,25)/t16-/m1/s1
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| InChIKey |
IJBTYJPHTARPJE-MRXNPFEDSA-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