General Information of the Compound
| Compound ID |
CP0968151
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| Compound Name |
2-(1-amino-3-(benzyloxy)propyl)-6-(1-methyl-1H-pyrazol-4-yl)quinazolin-4(3H)-one
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| Structure |
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| Formula |
C22H23N5O2
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| Molecular Weight |
389.459
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| Canonical SMILES |
Cn1cc(-c2ccc3nc(C(N)CCOCc4ccccc4)[nH]c(=O)c3c2)cn1
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| InChI |
InChI=1S/C22H23N5O2/c1-27-13-17(12-24-27)16-7-8-20-18(11-16)22(28)26-21(25-20)19(23)9-10-29-14-15-5-3-2-4-6-15/h2-8,11-13,19H,9-10,14,23H2,1H3,(H,25,26,28)
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| InChIKey |
PNNZQIZIFWBSKE-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