General Information of the Compound
| Compound ID |
CP0478918
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| Compound Name |
(2S,5R)-5-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C19H21FN2O3
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| Molecular Weight |
344.386
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| Canonical SMILES |
COc1cc(ccc1OCc1ccccc1F)[C@H]1CC[C@H](N1)C(N)=O
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| InChI |
InChI=1S/C19H21FN2O3/c1-24-18-10-12(15-7-8-16(22-15)19(21)23)6-9-17(18)25-11-13-4-2-3-5-14(13)20/h2-6,9-10,15-16,22H,7-8,11H2,1H3,(H2,21,23)/t15-,16+/m1/s1
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| InChIKey |
SNOYMERIIZYNOF-CVEARBPZSA-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