COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555199
Chemical Name: 2-(azepan-1-yl)-N-(3-chlorophenyl)-5-nitropyrimidine-4,6-diamine
Smiles: Clc1cccc(c1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCCCCC1

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Molecular Weight: 362.82
Empirical Formula: C16H19ClN6O2

Physical State: Dry powder
Available Amount: 440 mg

Lipinsky:
logP: 8.199
Rotatable bonds: 0
H-donors: 3
H-acceptors: 2
PSA: 112
Number of rings: 3

     

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