General Information of the Compound
| Compound ID |
CP0428288
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| Compound Name |
5-[(3-Bromophenyl)amino]-1-[3-(4-morpholino)propyl]-pyrrolo[3,2-g]quinazoline
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| Structure |
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| Formula |
C23H24BrN5O
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| Molecular Weight |
466.383
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| Canonical SMILES |
Brc1cccc(Nc2ncnc3cc4n(CCCN5CCOCC5)ccc4cc23)c1
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| InChI |
InChI=1S/C23H24BrN5O/c24-18-3-1-4-19(14-18)27-23-20-13-17-5-8-29(22(17)15-21(20)25-16-26-23)7-2-6-28-9-11-30-12-10-28/h1,3-5,8,13-16H,2,6-7,9-12H2,(H,25,26,27)
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| InChIKey |
NFCOOGUSNHUTQY-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