General Information of the Compound
| Compound ID |
CP0213376
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| Compound Name |
1-(3-(4-(5-fluoro-4-methyl-1H-benzo[d]imidazol-2-yl)-3-methylphenoxy)propyl)pyrrolidin-3-amine
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| Structure |
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| Formula |
C22H27FN4O
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| Molecular Weight |
382.483
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| Canonical SMILES |
Cc1cc(OCCCN2CCC(N)C2)ccc1-c1nc2ccc(F)c(C)c2[nH]1
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| InChI |
InChI=1S/C22H27FN4O/c1-14-12-17(28-11-3-9-27-10-8-16(24)13-27)4-5-18(14)22-25-20-7-6-19(23)15(2)21(20)26-22/h4-7,12,16H,3,8-11,13,24H2,1-2H3,(H,25,26)
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| InChIKey |
WPNCELZQJWIUHO-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