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Details

Stereochemistry ACHIRAL
Molecular Formula C25H29N3O3
Molecular Weight 419.5161
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-202

SMILES

COC1=NC(OCC2=C(C)C(=CC=C2)C3=CC=CC=C3)=CC=C1CNCCNC(C)=O

InChI

InChIKey=JEDPSOYOYVELLZ-UHFFFAOYSA-N
InChI=1S/C25H29N3O3/c1-18-22(10-7-11-23(18)20-8-5-4-6-9-20)17-31-24-13-12-21(25(28-24)30-3)16-26-14-15-27-19(2)29/h4-13,26H,14-17H2,1-3H3,(H,27,29)

HIDE SMILES / InChI

Molecular Formula C25H29N3O3
Molecular Weight 419.5161
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
18.0 nM [IC50]

PubMed

Substance Class Chemical
Record UNII
KDA2HUE7KP
Record Status Validated (UNII)
Record Version