General Information of the Compound
| Compound ID |
CP0503862
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| Compound Name |
tert-butyl N-[3-[[2-[8-(4-tert-butylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]acetyl]amino]propyl]carbamate
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| Structure |
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| Formula |
C34H47N5O5
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| Molecular Weight |
605.78
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| Canonical SMILES |
CC(C)(C)OC(=O)NCCCNC(=O)CN1CN(c2ccccc2)C2(CCN(CC2)C(=O)c2ccc(cc2)C(C)(C)C)C1=O
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| InChI |
InChI=1S/C34H47N5O5/c1-32(2,3)26-15-13-25(14-16-26)29(41)37-21-17-34(18-22-37)30(42)38(24-39(34)27-11-8-7-9-12-27)23-28(40)35-19-10-20-36-31(43)44-33(4,5)6/h7-9,11-16H,10,17-24H2,1-6H3,(H,35,40)(H,36,43)
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| InChIKey |
LOZWVJISMLUCQZ-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