COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029327
Chemical Name: (6Z)-2-cyclohexyl-6-({1-[2-(2,4-dimethylphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(c(c1)C)OCCn1cccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1

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Molecular Weight: 475.61
Empirical Formula: C26H29N5O2S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 4.635
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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