General Information of the Compound
| Compound ID |
CP0508212
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| Compound Name |
N-[(1S)-3-methyl-1-(2H-tetrazol-5-yl)butyl]-2-(5-quinolin-3-ylindol-1-yl)acetamide
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| Structure |
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| Formula |
C25H25N7O
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| Molecular Weight |
439.523
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| Canonical SMILES |
CC(C)C[C@H](NC(=O)Cn1ccc2cc(ccc12)-c1cnc2ccccc2c1)c1nn[nH]n1
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| InChI |
InChI=1S/C25H25N7O/c1-16(2)11-22(25-28-30-31-29-25)27-24(33)15-32-10-9-19-12-17(7-8-23(19)32)20-13-18-5-3-4-6-21(18)26-14-20/h3-10,12-14,16,22H,11,15H2,1-2H3,(H,27,33)(H,28,29,30,31)/t22-/m0/s1
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| InChIKey |
MHNQUODQQGVIFY-QFIPXVFZSA-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