COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712816
Chemical Name: (6Z)-2-(3,4-dimethoxybenzyl)-6-[(2,5-dimethyl-1H-indol-3-yl)methylidene]-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OC)Cc1nn2c(=NC(=O)/C(=C\c3c(C)[nH]c4c3cc(C)cc4)/C2=N)s1

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Molecular Weight: 473.56
Empirical Formula: C25H23N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.202
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 128
Number of rings: 5

     

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