COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003089
Chemical Name: (2E)-2-cyano-3-{2,5-dimethyl-1-[4-(morpholin-4-yl)-3-nitrophenyl]-1H-pyrrol-3-yl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)C)/C(=O)NCC1CCCO1

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Molecular Weight: 479.54
Empirical Formula: C25H29N5O5

Physical State: Dry powder
Available Amount: 464 mg

Lipinsky:
logP: 2.961
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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