Details of the Drug

General Information of Drug (ID: DMC1SZT)

Drug Name

PV-267

Synonyms

HLA-DR2 inhibitor (peptidomimetic, multiple sclerosis), Provid

Indication

Disease Entry	ICD 11	Status	REF
Multiple sclerosis	8A40	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C40H57N9O6
Canonical SMILES: CC(C)C(C(=O)N(CC(=O)NC(CCCN=C(N)N)C(=O)N1CC2=CC=CC=C2CC1C(=O)NC(CC3=CC=CC=C3)C(=O)N)C4CCCCC4)NC(=O)C
InChI: 1S/C40H57N9O6/c1-25(2)35(45-26(3)50)39(55)48(30-17-8-5-9-18-30)24-34(51)46-31(19-12-20-44-40(42)43)38(54)49-23-29-16-11-10-15-28(29)22-33(49)37(53)47-32(36(41)52)21-27-13-6-4-7-14-27/h4,6-7,10-11,13-16,25,30-33,35H,5,8-9,12,17-24H2,1-3H3,(H2,41,52)(H,45,50)(H,46,51)(H,47,53)(H4,42,43,44)/t31-,32-,33-,35-/m0/s1
InChIKey: NRHMIZFGJDOCJV-TUCRWICHSA-N

Cross-matching ID

References

1	The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.