COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK881565
Chemical Name: (2Z)-3-{3-[4-(butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-cyano-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide
Smiles: CCCCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NCCCn1cncc1)/C#N)c1ccccc1

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Molecular Weight: 510.66
Empirical Formula: C29H30N6OS

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 5.336
Rotatable bonds: 9
H-donors: 1
H-acceptors: 1
PSA: 113
Number of rings: 4

     

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