COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543464
Chemical Name: N~1~,N~1~-diethyl-N~4~-{6-nitro-2-[(E)-2-(2,4,6-trichlorophenyl)ethenyl]quinazolin-4-yl}pentane-1,4-diamine
Smiles: CCN(CCCC(Nc1nc(/C=C/c2c(Cl)cc(cc2Cl)Cl)nc2c1cc(cc2)[N+](=O)[O-])C)CC

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Saltdata: HCl
Molecular Weight: 536.89
Empirical Formula: C25H28Cl3N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.271
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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