General Information of the Compound
| Compound ID |
CP0493017
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| Compound Name |
2-[1-(2,3-dihydro-1H-inden-2- ylmethyl)imidazol-4-yl]-4-(2H- tetrazol-5-yl)pyridine
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| Structure |
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| Formula |
C19H17N7
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| Molecular Weight |
343.394
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| Canonical SMILES |
C(C1Cc2ccccc2C1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
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| InChI |
InChI=1S/C19H17N7/c1-2-4-15-8-13(7-14(15)3-1)10-26-11-18(21-12-26)17-9-16(5-6-20-17)19-22-24-25-23-19/h1-6,9,11-13H,7-8,10H2,(H,22,23,24,25)
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| InChIKey |
AEINLPGZMRICQO-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: PT03776, Lysine-specific demethylase 2B
Protein ID: PT02979, Lysine-specific demethylase 4C