General Information of the Compound
| Compound ID |
CP0953984
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| Compound Name |
O-Benzyl-N-{[6-(2-phenethyl)imidazo[1,2-a]pyridin-2-yl]carbonyl}tyrosine
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| Structure |
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| Formula |
C32H29N3O4
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| Molecular Weight |
519.601
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| Canonical SMILES |
O=C(NC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O)c1cn2cc(CCc3ccccc3)ccc2n1
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| InChI |
InChI=1S/C32H29N3O4/c36-31(29-21-35-20-25(15-18-30(35)33-29)12-11-23-7-3-1-4-8-23)34-28(32(37)38)19-24-13-16-27(17-14-24)39-22-26-9-5-2-6-10-26/h1-10,13-18,20-21,28H,11-12,19,22H2,(H,34,36)(H,37,38)
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| InChIKey |
TWSXTSPPLQSRBN-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