General Information of the Compound
| Compound ID |
CP0449281
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| Compound Name |
4-oxo-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-3-phenylphthalazine-1-carboxamide
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| Structure |
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| Formula |
C20H15N5O3S
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| Molecular Weight |
405.439
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| Canonical SMILES |
O=C(CNC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12)Nc1nccs1
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| InChI |
InChI=1S/C20H15N5O3S/c26-16(23-20-21-10-11-29-20)12-22-18(27)17-14-8-4-5-9-15(14)19(28)25(24-17)13-6-2-1-3-7-13/h1-11H,12H2,(H,22,27)(H,21,23,26)
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| InChIKey |
BNASUZSFJRXZHS-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