General Information of the Compound
| Compound ID |
CP0513907
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| Compound Name |
4-(4-(3-hydroxypyrrolidin-1-yl)-6-phenylpicolinamido)-5-oxo-5-(4-(pentyloxycarbonyl)piperazin-1-yl)pentanoic acid
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| Structure |
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| Formula |
C31H41N5O7
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| Molecular Weight |
595.697
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| Canonical SMILES |
CCCCCOC(=O)N1CCN(CC1)C(=O)C(CCC(O)=O)NC(=O)c1cc(cc(n1)-c1ccccc1)N1CCC(O)C1
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| InChI |
InChI=1S/C31H41N5O7/c1-2-3-7-18-43-31(42)35-16-14-34(15-17-35)30(41)25(10-11-28(38)39)33-29(40)27-20-23(36-13-12-24(37)21-36)19-26(32-27)22-8-5-4-6-9-22/h4-6,8-9,19-20,24-25,37H,2-3,7,10-18,21H2,1H3,(H,33,40)(H,38,39)
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| InChIKey |
YBRICPHMUGKTCX-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