General Information of the Compound
| Compound ID |
CP0445319
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| Compound Name |
N-(cyclopropylmethyl)-2-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-3,8-dimethyl-N-(oxan-4-yl)quinolin-5-amine
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| Structure |
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| Formula |
C30H38N2O4
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| Molecular Weight |
490.644
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| Canonical SMILES |
COCc1cc(OC)c(c(OC)c1)-c1nc2c(C)ccc(N(CC3CC3)C3CCOCC3)c2cc1C
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| InChI |
InChI=1S/C30H38N2O4/c1-19-6-9-25(32(17-21-7-8-21)23-10-12-36-13-11-23)24-14-20(2)30(31-29(19)24)28-26(34-4)15-22(18-33-3)16-27(28)35-5/h6,9,14-16,21,23H,7-8,10-13,17-18H2,1-5H3
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| InChIKey |
KRLIAVORQGBCRZ-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