COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261772
Chemical Name: dimethyl5-({[2-(5-methyl-1H-indol-3-yl)ethyl]carbamothioyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=S)NCCc2c[nH]c3c2cc(C)cc3)cc(c1)C(=O)OC

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Molecular Weight: 425.51
Empirical Formula: C22H23N3O4S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 4.396
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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