General Information of the Compound
| Compound ID |
CP0397535
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| Compound Name |
N-[3-(3-amino-5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)propyl]acetamide
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| Structure |
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| Formula |
C21H19N3O3
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| Molecular Weight |
361.401
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| Canonical SMILES |
CC(=O)NCCCn1c2-c3ccccc3C(=O)c2c2ccc(N)cc2c1=O
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| InChI |
InChI=1S/C21H19N3O3/c1-12(25)23-9-4-10-24-19-15-5-2-3-6-16(15)20(26)18(19)14-8-7-13(22)11-17(14)21(24)27/h2-3,5-8,11H,4,9-10,22H2,1H3,(H,23,25)
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| InChIKey |
NRPQUZCFMRCDRJ-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