COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767974
Chemical Name: (3E)-4-[3-(4-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one
Smiles: COc1ccc2c(c1)C1=NN(C(C1CC2)c1ccc(cc1)F)/C(=C/C(=O)C)/C

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Molecular Weight: 378.45
Empirical Formula: C23H23FN2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.756
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 4

     

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