General Information of the Compound
| Compound ID |
CP0099311
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| Compound Name |
(2S)-2-[({4-[(3-fluorophenyl)methoxy]phenyl}methyl)amino]propanamide
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| Synonyms |
(2S)-2-[[4-[(3-Fluorophenyl)methoxy]phenyl]methylamino]propanamide
(S)-2-(((4-((3-Fluorophenyl)methoxy)phenyl)methyl)amino)propanamide
(S)-2-((4-((3-Fluorobenzyl)oxy)benzyl)amino)propanamide
133865-89-1
2(s)-(4-(3-fluorobenzyloxy)benzylamino)propionamide
2-(4-(3-Fluorobenzyloxy)benzylamino)propionamide
90ENL74SIG
AC1L2ZLK
AK-77847
CHEMBL396778
CHEMBL48582
EC 603-772-2
EMD 1195686
EMD-1195686
Fce 26743
Fce-26743
ON 019190.Na
SCHEMBL69350
Safinamide
Safinamide (USAN/INN)
Safinamide [USAN:INN]
UNII-90ENL74SIG
Xadago
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| Structure |
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| Formula |
C17H19FN2O2
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| Molecular Weight |
302.349
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| Canonical SMILES |
C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)C(N)=O
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| InChI |
InChI=1S/C17H19FN2O2/c1-12(17(19)21)20-10-13-5-7-16(8-6-13)22-11-14-3-2-4-15(18)9-14/h2-9,12,20H,10-11H2,1H3,(H2,19,21)/t12-/m0/s1
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| InChIKey |
NEMGRZFTLSKBAP-LBPRGKRZSA-N
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| CAS |
133865-89-1
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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
Protein ID: PT00918, Amine oxidase [flavin-containing] A
Cell-based Assay
Protein ID: PT01362, Amine oxidase [flavin-containing] B
Cell-based Assay
Clinical Information about the Compound