COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007822
Chemical Name: (6Z)-2-butyl-6-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3ccc(cc3)Cl)/C2=N)s1

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Molecular Weight: 412.9
Empirical Formula: C20H17ClN4O2S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 4.418
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 107
Number of rings: 4

     

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