General Information of the Compound
| Compound ID |
CP0421460
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| Compound Name |
(2E)-N-{(3R)-1-[(6-fluoro-2-naphthyl)methyl]pyrrolidin-3-yl}-3-phenylacrylamide
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| Structure |
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| Formula |
C24H23FN2O
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| Molecular Weight |
374.459
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| Canonical SMILES |
Fc1ccc2cc(CN3CC[C@H](C3)NC(=O)\C=C\c3ccccc3)ccc2c1
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| InChI |
InChI=1S/C24H23FN2O/c25-22-10-9-20-14-19(6-8-21(20)15-22)16-27-13-12-23(17-27)26-24(28)11-7-18-4-2-1-3-5-18/h1-11,14-15,23H,12-13,16-17H2,(H,26,28)/b11-7+/t23-/m1/s1
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| InChIKey |
DXMGONNADLQMGE-GULCCPCXSA-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