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Drug Details

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Name:2-(3-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-5-BROMO-4-OXIDOPHENYL)SUCCINATE
PubChem ID:6398402
Pathway:Show KEGG pathways
InChI:InChI=1/C18H15BrN4O5/c19-11-4-8(9(18(27)28)6-14(24)25)3-10(15(11)26)17-22-12-2-1-7(16(20)21)5-13(12)23-17/h1-5,9,17,26H,6H2,(H3,20,21)(H,24,25)(H,27,28)/p-1/t9-,17?/m1/s1/fC18H14BrN4O5/h26h,22H,20-21H2/q-1
SMILES:c1cc=2c(cc1C(=[NH+])N)=NC(c1cc(cc(c1[O-])Br)[C@H](CC(=O)[O-])C([O-])=O)[N+]2

Properties:
Formula:C18H13BrN4O5Atoms:28
Molecular Weight:445.224Rotatable Bonds:6
H-bond Acceptors:9H-bond Donors:0
logP:-3.4461
Targets:
NameUniprot IDSourceReferencesInteraction
Cationic trypsinTRY1_BOVINDrugBank-shows
Synonyms:
(2R)-2-[3-[5-[amino(azaniumylidene)methyl]-2H-benzimidazol-1-ium-2-yl]-5-b
2-(3-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-5-BROMO-4-OXIDOPHENYL)SUCCINATE
AC1O4QH1
CID6398402
CRA_16847