COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK467128
Chemical Name: propan-2-yl2-{[(2E)-2-cyano-3-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(c(c1)Cn1nc(cc1C)C)OC)/C(=O)Nc1sccc1C(=O)OC(C)C

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Molecular Weight: 478.57
Empirical Formula: C25H26N4O4S

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 6.101
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 134
Number of rings: 3

     

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