COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK654218
Chemical Name: 4-{[2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazol-6-yl]carbonyl}piperazin-2-one
Smiles: O=C1NCCN(C1)C(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

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Molecular Weight: 354.43
Empirical Formula: C18H18N4O2S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.153
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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