General Information of the Compound
| Compound ID |
CP0909890
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| Compound Name |
2-(2-(2-(1H-benzo[d]imidazol-2-yl)ethylamino)ethyl)-N-((3-fluoropyridin-2-yl)methyl)-5-methyloxazole-4-carboxamide
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| Structure |
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| Formula |
C22H23FN6O2
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| Molecular Weight |
422.464
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| Canonical SMILES |
Cc1oc(CCNCCc2nc3ccccc3[nH]2)nc1C(=O)NCc1ncccc1F
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| InChI |
InChI=1S/C22H23FN6O2/c1-14-21(22(30)26-13-18-15(23)5-4-10-25-18)29-20(31-14)9-12-24-11-8-19-27-16-6-2-3-7-17(16)28-19/h2-7,10,24H,8-9,11-13H2,1H3,(H,26,30)(H,27,28)
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| InChIKey |
DSPOJCXYXVAKNF-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: PT06104, Solute carrier family 40 member 1
Protein ID: PT06354, Solute carrier family 40 member 1