COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811210
Chemical Name: propan-2-yl(2Z)-2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CC(OC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)Cl)c1ccccc1)/s2)C

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Saltdata: 1/4CH3COOH
Molecular Weight: 601.15
Empirical Formula: C31H25ClN4O3S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 8.196
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 130
Number of rings: 6

     

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