COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK260305
Chemical Name: N-(4-chloro-3-nitrophenyl)-4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)[N+](=O)[O-])Cl)CCCN1C(=O)C2C(C1=O)CC=CC2

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Molecular Weight: 391.81
Empirical Formula: C18H18ClN3O5

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 2.995
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 3

     

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