COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870179
Chemical Name: N-[9-(2-carboxyphenyl)-6-(diethylamino)-3H-xanthen-3-ylidene]-N-ethylethanaminium
Smiles: CCN(c1ccc2c(c1)oc1c(c2c2ccccc2C(=O)O)ccc(=[N+](CC)CC)c1)CC

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Saltdata: Cl-
Molecular Weight: 443.57
Empirical Formula: C28H31N2O3

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 0
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 52
Number of rings: 4

     

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