General Information of the Compound
| Compound ID |
CP0894418
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| Compound Name |
SID56324743
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| Structure |
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| Formula |
C26H31N5O6S
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| Molecular Weight |
541.63
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| Canonical SMILES |
CC(=O)Nc1sc(C)c(C)c1C(=O)OCC(=O)N(CC(C)C)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
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| InChI |
InChI=1S/C26H31N5O6S/c1-14(2)11-30(19(33)13-37-25(35)20-15(3)16(4)38-24(20)28-17(5)32)21-22(27)31(26(36)29-23(21)34)12-18-9-7-6-8-10-18/h6-10,14H,11-13,27H2,1-5H3,(H,28,32)(H,29,34,36)
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| InChIKey |
AWTPQIITHXOIHA-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