General Information of the Compound
| Compound ID |
CP0401908
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| Compound Name |
7-chloro-N-methyl-2-(4-methylpiperazin-1-yl)quinazolin-4-amine
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| Structure |
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| Formula |
C14H18ClN5
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| Molecular Weight |
291.786
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| Canonical SMILES |
CNc1nc(nc2cc(Cl)ccc12)N1CCN(C)CC1
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| InChI |
InChI=1S/C14H18ClN5/c1-16-13-11-4-3-10(15)9-12(11)17-14(18-13)20-7-5-19(2)6-8-20/h3-4,9H,5-8H2,1-2H3,(H,16,17,18)
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| InChIKey |
ZXHALLHEVZLUOS-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