General Information of the Compound
| Compound ID |
CP0393235
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| Compound Name |
tert-butyl N-[[[2-[8-(4-cyclohexylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]acetyl]amino]methyl]carbamate
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| Structure |
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| Formula |
C34H45N5O5
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| Molecular Weight |
603.764
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| Canonical SMILES |
CC(C)(C)OC(=O)NCNC(=O)CN1CN(c2ccccc2)C2(CCN(CC2)C(=O)c2ccc(cc2)C2CCCCC2)C1=O
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| InChI |
InChI=1S/C34H45N5O5/c1-33(2,3)44-32(43)36-23-35-29(40)22-38-24-39(28-12-8-5-9-13-28)34(31(38)42)18-20-37(21-19-34)30(41)27-16-14-26(15-17-27)25-10-6-4-7-11-25/h5,8-9,12-17,25H,4,6-7,10-11,18-24H2,1-3H3,(H,35,40)(H,36,43)
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| InChIKey |
MSAURAMVTGXNQF-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