COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL244271
Chemical Name: 4-[7-hydroxy-3-methyl-4-(thiophen-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1cccs1)c(nn2c1ccc(cc1)C(=O)O)C

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Molecular Weight: 385.47
Empirical Formula: C18H15N3O3S2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 2.946
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 141
Number of rings: 4

     

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