COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185206
Chemical Name: methyl3-(3-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Smiles: N#C/C(=C\c1cc(n(c1C)c1cccc(c1)C(=O)OC)C)/C(=O)NCc1ccco1

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Molecular Weight: 403.44
Empirical Formula: C23H21N3O4

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 4.018
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 97
Number of rings: 3

     

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