COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK449466
Chemical Name: 1,4-bis[(pentamethylphenyl)sulfonyl]-1,4-diazepane
Smiles: Cc1c(C)c(C)c(c(c1S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1c(C)c(C)c(c(c1C)C)C)C)C

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Molecular Weight: 520.76
Empirical Formula: C27H40N2O4S2

Physical State: Dry powder
Available Amount: 2545 mg

Lipinsky:
logP: 7.737
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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