COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326931
Chemical Name: 4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-N,N,N-trimethylanilinium
Smiles: N#CC1=C(N)OC2=C(C1c1ccc(cc1)[N+](C)(C)C)C(=O)CC(C2)(C)C

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Saltdata: I-
Molecular Weight: 352.46
Empirical Formula: C21H26N3O2

Available Amount: 0 mg

Lipinsky:
logP: -2.149
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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