COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382113
Chemical Name: 7-methyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: CC1CCc2c(C1)sc1c2C(=O)NC(N1)c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 387.42
Empirical Formula: C18H17N3O5S

Physical State: Dry powder
Available Amount: 597 mg

Lipinsky:
logP: 3.299
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 133
Number of rings: 5

     

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