General Information of the Compound
| Compound ID |
CP0546063
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| Compound Name |
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]-N-(2-morpholin-4-ylethyl)propanamide
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| Structure |
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| Formula |
C23H30FN3O3
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| Molecular Weight |
415.509
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| Canonical SMILES |
C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)C(=O)NCCN1CCOCC1
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| InChI |
InChI=1S/C23H30FN3O3/c1-18(23(28)25-9-10-27-11-13-29-14-12-27)26-16-19-5-7-22(8-6-19)30-17-20-3-2-4-21(24)15-20/h2-8,15,18,26H,9-14,16-17H2,1H3,(H,25,28)/t18-/m0/s1
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| InChIKey |
RASUJTGTYKRJLR-SFHVURJKSA-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