COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL243517
Chemical Name: 3-(3-acetyl-1H-indol-1-yl)-1-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]propan-1-one
Smiles: O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)CCn1cc(c2c1cccc2)C(=O)C

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Molecular Weight: 417.53
Empirical Formula: C21H27N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.009
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 4

     

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