COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751977
Chemical Name: 3-(3-chlorophenyl)-1-(5,5-dimethyl-3-{[(1E,2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]amino}-2-thioxo-1,3-thiazolidin-4-yl)-1-hydroxyurea
Smiles: Clc1cccc(c1)NC(=O)N(C1N(/N=C/C=C/c2ccc(o2)[N+](=O)[O-])C(=S)SC1(C)C)O

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Molecular Weight: 495.97
Empirical Formula: C19H18ClN5O5S2

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 4.545
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 184
Number of rings: 3

     

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