General Information of the Compound
| Compound ID |
CP0398724
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| Compound Name |
tert-butyl N-[12-oxo-12-[3-[2-(2-oxo-1,3-dihydroindol-4-yl)ethyl-propylamino]propylamino]dodecyl]carbamate
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| Structure |
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| Formula |
C33H56N4O4
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| Molecular Weight |
572.835
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| Canonical SMILES |
CCCN(CCCNC(=O)CCCCCCCCCCCNC(=O)OC(C)(C)C)CCc1cccc2NC(=O)Cc12
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| InChI |
InChI=1S/C33H56N4O4/c1-5-23-37(25-20-27-17-15-18-29-28(27)26-31(39)36-29)24-16-22-34-30(38)19-13-11-9-7-6-8-10-12-14-21-35-32(40)41-33(2,3)4/h15,17-18H,5-14,16,19-26H2,1-4H3,(H,34,38)(H,35,40)(H,36,39)
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| InChIKey |
WCZVRYOCPPENFW-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