COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK742014
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-[(1E)-N-cyclopentylethanimidoyl]-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: C/C(=N\C1CCCC1)/c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

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Molecular Weight: 340.45
Empirical Formula: C18H20N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.171
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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