General Information of the Compound
| Compound ID |
CP0477283
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| Compound Name |
7-(hydroxymethyl)-4-[2-methyl-3-(4-oxoquinazolin-3-yl)phenyl]-9H-carbazole-1-carboxamide
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| Structure |
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| Formula |
C29H22N4O3
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| Molecular Weight |
474.52
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| Canonical SMILES |
Cc1c(cccc1-n1cnc2ccccc2c1=O)-c1ccc(C(N)=O)c2[nH]c3cc(CO)ccc3c12
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| InChI |
InChI=1S/C29H22N4O3/c1-16-18(6-4-8-25(16)33-15-31-23-7-3-2-5-21(23)29(33)36)19-11-12-22(28(30)35)27-26(19)20-10-9-17(14-34)13-24(20)32-27/h2-13,15,32,34H,14H2,1H3,(H2,30,35)
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| InChIKey |
BLCYNCYEVKSIKF-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