COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL399446
Chemical Name: (2E,5E)-2,5-bis[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzylidene]cyclopentanone
Smiles: COc1ccc(cc1Cn1cccn1)/C=C/1\CC/C(=C\c2ccc(c(c2)Cn2cccn2)OC)/C1=O

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Molecular Weight: 480.57
Empirical Formula: C29H28N4O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.562
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 71
Number of rings: 5

     

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