General Information of the Compound
| Compound ID |
CP0373641
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| Compound Name |
N-[2-[1-(4-bromophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]naphthalene-2-carboxamide
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| Structure |
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| Formula |
C26H27BrN4O2
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| Molecular Weight |
507.432
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| Canonical SMILES |
Brc1ccc(cc1)N1CNC(=O)C11CCN(CCNC(=O)c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C26H27BrN4O2/c27-22-7-9-23(10-8-22)31-18-29-25(33)26(31)11-14-30(15-12-26)16-13-28-24(32)21-6-5-19-3-1-2-4-20(19)17-21/h1-10,17H,11-16,18H2,(H,28,32)(H,29,33)
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| InChIKey |
UGINRQRGYNEXNI-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
Protein ID: PT01943, Phospholipase D1
Protein ID: PT01153, Phospholipase D2