General Information of the Compound
| Compound ID |
CP0355373
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| Compound Name |
N-(2-aminoethyl)-N-benzyl-1-methyl-4H-chromeno[4,3-c]pyrazole-3-carboxamide
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| Structure |
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| Formula |
C21H22N4O2
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| Molecular Weight |
362.433
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| Canonical SMILES |
Cn1nc(C(=O)N(CCN)Cc2ccccc2)c2COc3ccccc3-c12
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| InChI |
InChI=1S/C21H22N4O2/c1-24-20-16-9-5-6-10-18(16)27-14-17(20)19(23-24)21(26)25(12-11-22)13-15-7-3-2-4-8-15/h2-10H,11-14,22H2,1H3
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| InChIKey |
NPZOLEBIGLVKET-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