General Information of the Compound
| Compound ID |
CP0691706
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| Compound Name |
(R)-N-(1-(4-(7-Methyl-6-(pyridin-4-yl)quinazolin-2-ylamino)-phenyl)ethyl)acetamide
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| Structure |
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| Formula |
C24H23N5O
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| Molecular Weight |
397.482
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| Canonical SMILES |
CC(=O)N[C@H](C)c1ccc(Nc2ncc3cc(-c4ccncc4)c(C)cc3n2)cc1
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| InChI |
InChI=1S/C24H23N5O/c1-15-12-23-20(13-22(15)19-8-10-25-11-9-19)14-26-24(29-23)28-21-6-4-18(5-7-21)16(2)27-17(3)30/h4-14,16H,1-3H3,(H,27,30)(H,26,28,29)/t16-/m1/s1
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| InChIKey |
HHCGZHIZMMSLLF-MRXNPFEDSA-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