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Gene Set: D4 : Boss - masdil


Collection D4 : Boss
Chemical Name masdil ( From PubChem : DILTIAZEM HYDROCHLORIDE )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotApprovedApprovedNotApprovedNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
450.979 g/mol 1 7 4.2355 True
Structure
InChI InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H/t20-,21+;/m1./s1
InChIKey HDRXZJPWHTXQRI-BHDTVMLSSA-N
Links

Gene (12 / 13)


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Source Type Unit Value Gene PMID Assay Other
BOSSText MiningCACNA1S
BOSSText MiningCASP3
BOSSText MiningCDT1
BOSSText MiningCYGB
BOSSText MiningCYP2C8
BOSSText MiningDECR1
BOSSText MiningGPX1
BOSSText MiningHLP
BOSSText MiningSLC25A20
PubChem NoneuMABCB1-GI(Protien) :
PubChem PotencyuM3.162EHMT2-GI(Protien) :
PubChem NoneuMSLC12A5-GI(Protien) :
ChEMBLPotencynM3162.300EHMT2
-Target : CHEMBL6032
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