General Information of the Compound
| Compound ID |
CP0918318
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| Compound Name |
(2R)-3-[4-[(2S)-butan-2-yl]phenyl]-2-(4-propan-2-ylphenyl)-1,2-dihydroquinazolin-4-one
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| Structure |
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| Formula |
C27H30N2O
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| Molecular Weight |
398.55
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| Canonical SMILES |
CC[C@H](C)c1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C(C)C)cc2)cc1
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| InChI |
InChI=1S/C27H30N2O/c1-5-19(4)21-14-16-23(17-15-21)29-26(22-12-10-20(11-13-22)18(2)3)28-25-9-7-6-8-24(25)27(29)30/h6-19,26,28H,5H2,1-4H3/t19-,26+/m0/s1
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| InChIKey |
DAVMPNDGZVXWPX-AFMDSPMNSA-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