COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK288983
Chemical Name: N-[1-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: O=C(N1CCc2c(C1)cccc2)CSc1nnc(n1C)C(NC(=O)c1ccccc1)C

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Molecular Weight: 435.55
Empirical Formula: C23H25N5O2S

Physical State: Dry powder
Available Amount: 251 mg

Lipinsky:
logP: 3.398
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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