General Information of the Compound
| Compound ID |
CP0241960
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| Compound Name |
N-(1-cyclohexylpiperidin-4-yl)-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
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| Structure |
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| Formula |
C34H55N7O2
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| Molecular Weight |
593.861
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| Canonical SMILES |
COc1cc2c(NC3CCN(CC3)C3CCCCC3)nc(nc2cc1OCCCN1CCCCC1)N1CCCN(C)CC1
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| InChI |
InChI=1S/C34H55N7O2/c1-38-15-9-19-41(23-22-38)34-36-30-26-32(43-24-10-18-39-16-7-4-8-17-39)31(42-2)25-29(30)33(37-34)35-27-13-20-40(21-14-27)28-11-5-3-6-12-28/h25-28H,3-24H2,1-2H3,(H,35,36,37)
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| InChIKey |
IIMUZXZNXNSSBG-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