COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK659085
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-[(2E)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]pyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)/N=c/1\[nH]nc(s1)C(C)C

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Molecular Weight: 388.45
Empirical Formula: C18H20N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.802
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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