General Information of the Compound
| Compound ID |
CP0551962
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| Compound Name |
CHEMBL5179504
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| Formula |
C26H28FN3O6
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| Molecular Weight |
497.523
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| Canonical SMILES |
CCOCc1nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2F)c(O)n1-c1c(OC)cccc1OC
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| InChI |
InChI=1S/C26H28FN3O6/c1-4-36-15-21-28-24(31)22(26(33)30(21)23-19(34-2)10-7-11-20(23)35-3)25(32)29-13-12-16(14-29)17-8-5-6-9-18(17)27/h5-11,16,33H,4,12-15H2,1-3H3/t16-/m0/s1
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| InChIKey |
LUXCTAQPHSQHRI-INIZCTEOSA-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