COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK798884
Chemical Name: propan-2-yl(2Z)-5-(4-methoxyphenyl)-7-methyl-2-[1-(4-methylbenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/1\c3ccccc3N(C1=O)Cc1ccc(cc1)C)/s2)C(=O)OC(C)C

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Saltdata: 1/4 CH3COOH
Molecular Weight: 593.7
Empirical Formula: C34H31N3O5S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 6.18
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 113
Number of rings: 6

     

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