General Information of the Compound
| Compound ID |
CP0527075
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| Compound Name |
2-(4-Hydroxy-3-methoxyphenyl)-2-(3-((S)-1-methoxy-4-methyl-1-oxopentan-2-yl)ureido)acetic acid
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| Structure |
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| Formula |
C17H24N2O7
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| Molecular Weight |
368.386
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| Canonical SMILES |
COC(=O)[C@H](CC(C)C)NC(=O)NC(C(O)=O)c1ccc(O)c(OC)c1
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| InChI |
InChI=1S/C17H24N2O7/c1-9(2)7-11(16(23)26-4)18-17(24)19-14(15(21)22)10-5-6-12(20)13(8-10)25-3/h5-6,8-9,11,14,20H,7H2,1-4H3,(H,21,22)(H2,18,19,24)/t11-,14?/m0/s1
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| InChIKey |
ZWTKHFHBGBHKOJ-ZSOXZCCMSA-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