General Information of the Compound
| Compound ID |
CP0469073
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| Compound Name |
N-(cyclopropylmethyl)-2-[2-(4-fluorophenyl)-6-(3-morpholin-4-ylpropoxy)-4-oxoquinazolin-3-yl]acetamide
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| Structure |
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| Formula |
C27H31FN4O4
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| Molecular Weight |
494.567
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| Canonical SMILES |
Fc1ccc(cc1)-c1nc2ccc(OCCCN3CCOCC3)cc2c(=O)n1CC(=O)NCC1CC1
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| InChI |
InChI=1S/C27H31FN4O4/c28-21-6-4-20(5-7-21)26-30-24-9-8-22(36-13-1-10-31-11-14-35-15-12-31)16-23(24)27(34)32(26)18-25(33)29-17-19-2-3-19/h4-9,16,19H,1-3,10-15,17-18H2,(H,29,33)
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| InChIKey |
OTZWFHDNRCNYJO-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