General Information of the Compound
| Compound ID |
CP0425653
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| Compound Name |
N-(5-aminopentyl)-2-[8-(4-tert-butylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]acetamide
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| Structure |
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| Formula |
C31H43N5O3
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| Molecular Weight |
533.717
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)N1CCC2(CC1)N(CN(CC(=O)NCCCCCN)C2=O)c1ccccc1
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| InChI |
InChI=1S/C31H43N5O3/c1-30(2,3)25-14-12-24(13-15-25)28(38)34-20-16-31(17-21-34)29(39)35(22-27(37)33-19-9-5-8-18-32)23-36(31)26-10-6-4-7-11-26/h4,6-7,10-15H,5,8-9,16-23,32H2,1-3H3,(H,33,37)
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| InChIKey |
JPFHGSLGSVPEBF-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