COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850588
Chemical Name: 2-{[4-(5-chloro-2-methoxyphenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}phthalazin-1(2H)-one
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1Cn1ncc2c(c1=O)cccc2)Cl

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Molecular Weight: 399.86
Empirical Formula: C18H14ClN5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.711
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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