COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL494249
Chemical Name: 4-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(piperidin-1-ylsulfonyl)-1,4-diazepan-1-yl]butan-1-one
Smiles: O=C(N1CCCN(CC1)S(=O)(=O)N1CCCCC1)CCCn1c(C)ccc1C

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Molecular Weight: 410.58
Empirical Formula: C20H34N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.355
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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