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Details

Stereochemistry ACHIRAL
Molecular Formula C28H30N4O4
Molecular Weight 486.5622
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SB-216641

SMILES

COC1=C(OCCN(C)C)C=C(NC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3C)C4=NOC(C)=N4)C=C1

InChI

InChIKey=JRNUKVFYILMMLX-UHFFFAOYSA-N
InChI=1S/C28H30N4O4/c1-18-16-22(27-29-19(2)36-31-27)10-12-24(18)20-6-8-21(9-7-20)28(33)30-23-11-13-25(34-5)26(17-23)35-15-14-32(3)4/h6-13,16-17H,14-15H2,1-5H3,(H,30,33)

HIDE SMILES / InChI

Molecular Formula C28H30N4O4
Molecular Weight 486.5622
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
9.0 null [pKi]
7.5 null [pKi]
7.3 null [pKi]
Substance Class Chemical
Record UNII
ZM4360761C
Record Status Validated (UNII)
Record Version