COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK205338
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone
Smiles: O=C(c1ccc2c(c1)OCCO2)CSc1nnc(o1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 399.38
Empirical Formula: C18H13N3O6S

Physical State: Dry powder
Available Amount: 176 mg

Lipinsky:
logP: 4.466
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 145
Number of rings: 4

     

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