COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK170861
Chemical Name: 2-(3-{(E)-[1-(3-bromophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\C(=O)NC(=O)N(C1=O)c1cccc(c1)Br

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Molecular Weight: 549.45
Empirical Formula: C26H21BrN4O3S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.807
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 5

     

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