COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312301
Chemical Name: 1-cycloheptyl-7-hydroxy-4-(3-hydroxyphenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: Oc1cccc(c1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCCCC1)O

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Molecular Weight: 373.48
Empirical Formula: C19H23N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.753
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 110
Number of rings: 4

     

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