COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538707
Chemical Name: (9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-3-(3-nitrophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccccc1C1C2=C(N=c3n1c(cs3)c1cccc(c1)[N+](=O)[O-])/C(=C/c1ccccc1Cl)/CCC2

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Molecular Weight: 546.48
Empirical Formula: C29H21Cl2N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.74
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 6

     

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