COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407433
Chemical Name: 5-[1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-3-oxo-2,3,4,6-tetrahydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-4-one
Smiles: OC1=Nc2c(C(SC1)c1cc3cccc4c3n(c1=O)CC4)c(=O)[nH]n2C1CCOC(C1)(C)C

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Molecular Weight: 466.56
Empirical Formula: C24H26N4O4S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.579
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 6

     

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