General Information of the Compound
| Compound ID |
CP0666160
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| Compound Name |
4-[(6-Pyridin-4-ylquinazolin-2-yl)amino]-N-(2-pyrrolidin-1-ylethyl)benzamide
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| Structure |
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| Formula |
C26H26N6O
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| Molecular Weight |
438.535
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| Canonical SMILES |
O=C(NCCN1CCCC1)c1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C26H26N6O/c33-25(28-13-16-32-14-1-2-15-32)20-3-6-23(7-4-20)30-26-29-18-22-17-21(5-8-24(22)31-26)19-9-11-27-12-10-19/h3-12,17-18H,1-2,13-16H2,(H,28,33)(H,29,30,31)
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| InChIKey |
LTZRVNRMZXWRRI-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