General Information of the Compound
| Compound ID |
CP0901590
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| Compound Name |
1-(3-(5-((((R)-2-((R)-1-(N-methylhydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)phenyl)cyclopropanecarboxylic acid
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| Structure |
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| Formula |
C27H35N3O7
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| Molecular Weight |
513.591
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cccc(C3(C(=O)O)CC3)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C27H35N3O7/c1-3-5-6-10-20(21(4-2)30(36)17-31)24(32)28-16-29-25(33)23-12-11-22(37-23)18-8-7-9-19(15-18)27(13-14-27)26(34)35/h7-9,11-12,15,17,20-21,36H,3-6,10,13-14,16H2,1-2H3,(H,28,32)(H,29,33)(H,34,35)/t20-,21-/m1/s1
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| InChIKey |
LCCPKWFFAFIYBM-NHCUHLMSSA-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: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2