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Gene Set: D1 - Approved - MONTELUKAST SODIUM


Collection D1 : Approved
Chemical Name MONTELUKAST SODIUM
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotApprovedNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
608.165 g/mol 1 5 7.6133 False(2/4)
Structure
InChI InChI=1S/C35H36ClNO3S.Na/c1-34(2,40)30-9-4-3-7-25(30)13-17-32(41-23-35(18-19-35)22-33(38)39)27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(36)21-31(26)37-29;/h3-12,14-16,20-21,32,40H,13,17-19,22-23H2,1-2H3,(H,38,39);/q;+1/p-1/b15-10+;/t32-;/m1./s1
InChIKey LBFBRXGCXUHRJY-HKHDRNBDSA-M
Links

Gene (10 / 13)


⊖ Less

Source Type Unit Value Gene PMID Assay Other
PubChem AhR Potency (uM)uM21.958AHR-GI(Protien) :
PubChem PotencyuM23.710AHR-GI(Protien) :
PubChem ATAD5 Potency (uM)uM28.726ATAD5-GI(Protien) :
PubChem uMATG4B-GI(Protien) :
PubChem uMCYSLTR1-GI(Protien) :
PubChem uMPLA2G1B-GI(Protien) :
PubChem PotencyuM213.313POLH-GI(Protien) :
PubChem PotencyuM44.668POLI-GI(Protien) :
PubChem PotencyuM84.368POLKGI(Protien) :
PubChem uMPPP1CA-GI(Protien) :
PubChem uMPPP1CA-GI(Protien) :
ChEMBLPotencynM79432.800KDM4A
-Target : CHEMBL5896
ChEMBLPotencynM44668.400POLI
-Target : CHEMBL5391
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