COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868748
Chemical Name: 2-{2,5-dimethyl-3-[(Z)-(1-methyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-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)C

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Molecular Weight: 408.48
Empirical Formula: C21H20N4O3S

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.283
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 4

     

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