COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK317639
Chemical Name: methyl4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)carbamothioyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)Cn1ncc(c1)Br

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Molecular Weight: 473.35
Empirical Formula: C20H17BrN4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.91
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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