COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682790
Chemical Name: (3E)-1,1-dichloro-4-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(morpholin-4-yl)but-3-en-2-one
Smiles: ClC(C(=O)/C=C(/n1nc(cc1C)C)\N1CCOCC1)Cl

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Molecular Weight: 318.2
Empirical Formula: C13H17Cl2N3O2

Physical State: Dry powder
Available Amount: 7 mg

Lipinsky:
logP: 3.371
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 47
Number of rings: 2

     

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