COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847351
Chemical Name: (3Z)-3-(azepan-2-ylidene)-1-(2,6-dichlorophenyl)-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: O=C1/C(=C\2/CCCCCN2)/c2c(N1c1c(Cl)cccc1Cl)ccc(c2)[N+](=O)[O-]

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Molecular Weight: 418.28
Empirical Formula: C20H17Cl2N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.693
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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