COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473458
Chemical Name: propan-2-yl2-({(2E)-3-[1-(2-chloro-4-fluorobenzyl)-1H-indol-3-yl]-2-cyanoprop-2-enoyl}amino)thiophene-3-carboxylate
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1Cl)F)/C(=O)Nc1sccc1C(=O)OC(C)C

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Molecular Weight: 522
Empirical Formula: C27H21ClFN3O3S

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 7.907
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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