COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712871
Chemical Name: 7-(4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: [O-][N+](=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)c1cc(=O)n2c(n1)sc(n2)C(C)C

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Molecular Weight: 519.63
Empirical Formula: C26H29N7O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.964
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 5

     

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