COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118351
Chemical Name: 4-{(E)-[5-imino-7-oxo-2-(thiophen-2-ylmethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl3-methylbenzoate
Smiles: Cc1cccc(c1)C(=O)Oc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)Cc1cccs1

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Molecular Weight: 486.58
Empirical Formula: C25H18N4O3S2

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 4.131
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 148
Number of rings: 5

     

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