COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598972
Chemical Name: 2-[(3aR,6aS)-3-(2,4-dichlorophenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1Cl)Cl

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Molecular Weight: 446.31
Empirical Formula: C20H13Cl2N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.729
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 5

     

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