COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL494492
Chemical Name: 3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(piperidin-1-ylsulfonyl)-1,4-diazepan-1-yl]propan-1-one
Smiles: O=C(N1CCCN(CC1)S(=O)(=O)N1CCCCC1)CCn1c(C)ccc1C

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Molecular Weight: 396.55
Empirical Formula: C19H32N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.081
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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