COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK694522
Chemical Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: COc1cc(cc2c1OCO2)C1SCC(=O)Nc2c1cn[nH]2

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Molecular Weight: 319.34
Empirical Formula: C14H13N3O4S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 2.255
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 110
Number of rings: 4

     

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