COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378665
Chemical Name: methyl7-{[(2Z,5Z)-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino}heptanoate
Smiles: COC(=O)CCCCCC/N=C/1\S/C(=c/2\sc3c(n2C)cc(cc3)OC)/C(=O)N1c1ccc(cc1)C

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Molecular Weight: 525.69
Empirical Formula: C27H31N3O4S2

Physical State: Dry powder
Available Amount: 627 mg

Lipinsky:
logP: 4.348
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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