COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK873207
Chemical Name: 2,4-dichloro-N-{(1Z)-3-oxo-1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]-3-[(pyridin-3-ylmethyl)amino]prop-1-en-2-yl}benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)N/C(=C\c1cn(nc1c1cccs1)c1ccccc1)/C(=O)NCc1cccnc1

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Molecular Weight: 574.49
Empirical Formula: C29H21Cl2N5O2S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 5.025
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 117
Number of rings: 5

     

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