COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK649401
Chemical Name: (6E)-5-imino-6-({1-[2-(3-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cccc(c1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1

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Molecular Weight: 540.65
Empirical Formula: C29H28N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.535
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 128
Number of rings: 6

     

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