General Information of the Compound
| Compound ID |
CP0379986
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| Compound Name |
N-[7-methoxy-4-[[(1R)-1-phenylethyl]amino]quinazolin-6-yl]propanamide
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| Structure |
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| Formula |
C20H22N4O2
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| Molecular Weight |
350.422
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| Canonical SMILES |
CCC(=O)Nc1cc2c(N[C@H](C)c3ccccc3)ncnc2cc1OC
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| InChI |
InChI=1S/C20H22N4O2/c1-4-19(25)24-17-10-15-16(11-18(17)26-3)21-12-22-20(15)23-13(2)14-8-6-5-7-9-14/h5-13H,4H2,1-3H3,(H,24,25)(H,21,22,23)/t13-/m1/s1
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| InChIKey |
MGAIHODHEWSWBP-CYBMUJFWSA-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