General Information of the Compound
| Compound ID |
CP0098551
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| Compound Name |
(3S)-N-[(2,6-difluorophenyl)methyl]-3-hydroxy-2-oxo-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C21H19F2N3O4
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| Molecular Weight |
415.396
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| Canonical SMILES |
O[C@@]1(CCN(C1=O)c1ccc2NC(=O)CCc2c1)C(=O)NCc1c(F)cccc1F
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| InChI |
InChI=1S/C21H19F2N3O4/c22-15-2-1-3-16(23)14(15)11-24-19(28)21(30)8-9-26(20(21)29)13-5-6-17-12(10-13)4-7-18(27)25-17/h1-3,5-6,10,30H,4,7-9,11H2,(H,24,28)(H,25,27)/t21-/m0/s1
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| InChIKey |
MRAITFMPEIETKJ-NRFANRHFSA-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