General Information of the Compound
| Compound ID |
CP0509650
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| Compound Name |
2-(8-(4-tert-butylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl)-N-isobutylacetamide
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| Structure |
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| Formula |
C30H40N4O3
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| Molecular Weight |
504.675
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| Canonical SMILES |
CC(C)CNC(=O)CN1CN(c2ccccc2)C2(CCN(CC2)C(=O)c2ccc(cc2)C(C)(C)C)C1=O
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| InChI |
InChI=1S/C30H40N4O3/c1-22(2)19-31-26(35)20-33-21-34(25-9-7-6-8-10-25)30(28(33)37)15-17-32(18-16-30)27(36)23-11-13-24(14-12-23)29(3,4)5/h6-14,22H,15-21H2,1-5H3,(H,31,35)
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| InChIKey |
HRZLSHMJWBKYGI-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