General Information of the Compound
| Compound ID |
CP0344438
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| Compound Name |
4'-(2,4-dioxo-1-phenyl-1,3,8-triaza-spiro[4.5]dec-8-ylmethyl)-biphenyl-3-carbonitrile
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| Structure |
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| Formula |
C27H24N4O2
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| Molecular Weight |
436.515
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| Canonical SMILES |
O=C1NC(=O)C2(CCN(Cc3ccc(cc3)-c3cccc(c3)C#N)CC2)N1c1ccccc1
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| InChI |
InChI=1S/C27H24N4O2/c28-18-21-5-4-6-23(17-21)22-11-9-20(10-12-22)19-30-15-13-27(14-16-30)25(32)29-26(33)31(27)24-7-2-1-3-8-24/h1-12,17H,13-16,19H2,(H,29,32,33)
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| InChIKey |
CPHIGNAWKKTAEQ-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