COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492162
Chemical Name: 4-(1-cyclopentyl-3,7-dioxo-2,3,4,6,7,8-hexahydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)benzoicacid
Smiles: O=C1CSC(c2c(N1)n([nH]c2=O)C1CCCC1)c1ccc(cc1)C(=O)O

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Molecular Weight: 373.43
Empirical Formula: C18H19N3O4S

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 3.497
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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