COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374740
Chemical Name: 3-ethyl-2-[(E)-2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)ethenyl]-1,3-benzoxazol-3-ium
Smiles: CCn1c(C)cc(c1C)/C=C/c1oc2c([n+]1CC)cccc2

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Saltdata: CH3C6H4SO3-
Molecular Weight: 295.4
Empirical Formula: C19H23N2O

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 21
Number of rings: 3

     

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