COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555265
Chemical Name: (6E)-6-({1-[3-(3,5-dimethylphenoxy)propyl]-1H-indol-3-yl}methylidene)-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cc(OCCCn2cc(c3c2cccc3)/C=C\2/C(=O)N=c3n(C2=N)nc(s3)c2cccnc2)cc(c1)C

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Molecular Weight: 534.64
Empirical Formula: C30H26N6O2S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 4.533
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 121
Number of rings: 6

     

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