General Information of the Compound
| Compound ID |
CP0388039
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| Compound Name |
N-[2-(6-oxo-3,7,8,9-tetrahydropyrrolo[3,2-f]isoquinolin-1-yl)ethyl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C19H18N4O2
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| Molecular Weight |
334.379
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| Canonical SMILES |
O=C(NCCc1c[nH]c2ccc3C(=O)NCCc3c12)c1cccnc1
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| InChI |
InChI=1S/C19H18N4O2/c24-18(13-2-1-7-20-10-13)21-8-5-12-11-23-16-4-3-15-14(17(12)16)6-9-22-19(15)25/h1-4,7,10-11,23H,5-6,8-9H2,(H,21,24)(H,22,25)
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| InChIKey |
MQPUTFKKYGPCBB-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