General Information of the Compound
| Compound ID |
CP0415308
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| Compound Name |
N-[(1S,2R)-2-methylcyclohexyl]-6-(1,3-thiazol-5-yl)quinazolin-4-amine
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| Structure |
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| Formula |
C18H20N4S
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| Molecular Weight |
324.453
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| Canonical SMILES |
C[C@@H]1CCCC[C@@H]1Nc1ncnc2ccc(cc12)-c1cncs1
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| InChI |
InChI=1S/C18H20N4S/c1-12-4-2-3-5-15(12)22-18-14-8-13(17-9-19-11-23-17)6-7-16(14)20-10-21-18/h6-12,15H,2-5H2,1H3,(H,20,21,22)/t12-,15+/m1/s1
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| InChIKey |
LVSOXTLPGDTVEC-DOMZBBRYSA-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