COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406695
Chemical Name: methyl4-{[(2E,5Z)-5-(1H-indol-3-ylmethylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1C

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Molecular Weight: 391.45
Empirical Formula: C21H17N3O3S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 4.716
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 4

     

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