COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK603034
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-[3-(4-methoxyphenyl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]prop-2-en-1-one
Smiles: COc1ccc(cc1)c1n[nH]c2c1CN(CC2)C(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 403.44
Empirical Formula: C23H21N3O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.568
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 76
Number of rings: 5

     

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