COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017715
Chemical Name: (6E)-6-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Clc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F

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Molecular Weight: 487.89
Empirical Formula: C22H13ClF3N5OS

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 4.991
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 99
Number of rings: 5

     

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