COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712872
Chemical Name: 7-(4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: CCCc1nn2c(s1)nc(cc2=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 519.63
Empirical Formula: C26H29N7O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.148
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 5

     

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