COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL224965
Chemical Name: (6E)-5-imino-6-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-[(3-methylphenoxy)methyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)COc1cccc(c1)C

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Molecular Weight: 499.59
Empirical Formula: C27H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.618
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 5

     

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