General Information of the Compound
| Compound ID |
CP0390956
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| Compound Name |
5-cyclopropyl-1-[4-[2-[(3R)- 3-hydroxy-1-methyl-2-oxo- pyrrolidin-3-yl]ethynyl]- 2-pyridyl]pyrazole-3-carbox- amide
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| Structure |
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| Formula |
C19H19N5O3
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| Molecular Weight |
365.393
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| Canonical SMILES |
CN1CC[C@@](O)(C#Cc2ccnc(c2)-n2nc(cc2C2CC2)C(N)=O)C1=O
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| InChI |
InChI=1S/C19H19N5O3/c1-23-9-7-19(27,18(23)26)6-4-12-5-8-21-16(10-12)24-15(13-2-3-13)11-14(22-24)17(20)25/h5,8,10-11,13,27H,2-3,7,9H2,1H3,(H2,20,25)/t19-/m0/s1
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| InChIKey |
WFIYKEJGYKFLJS-IBGZPJMESA-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