COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712869
Chemical Name: 7-{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)c1cc(=O)n2c(n1)sc(n2)C(C)C

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Molecular Weight: 505.6
Empirical Formula: C25H27N7O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.404
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 5

     

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