General Information of the Compound
| Compound ID |
CP0189624
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| Compound Name |
7,8-dimethoxy-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]quinazolin-4-amine
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| Structure |
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| Formula |
C17H21N5O2
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| Molecular Weight |
327.388
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| Canonical SMILES |
COc1ccc2c(NC(C)Cc3cc(C)[nH]n3)ncnc2c1OC
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| InChI |
InChI=1S/C17H21N5O2/c1-10(7-12-8-11(2)21-22-12)20-17-13-5-6-14(23-3)16(24-4)15(13)18-9-19-17/h5-6,8-10H,7H2,1-4H3,(H,21,22)(H,18,19,20)
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| InChIKey |
JTROLECZHRVLFM-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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