COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761499
Chemical Name: 2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-4-nitrophenol
Smiles: Oc1ccc(cc1C1SCc2c(CS1)cc(c(c2)C)C)[N+](=O)[O-]

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Molecular Weight: 347.46
Empirical Formula: C17H17NO3S2

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 6.25
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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