COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016731
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](9H-xanthen-9-yl)methanone
Smiles: O=C(C1c2ccccc2Oc2c1cccc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: HCI
Molecular Weight: 428.49
Empirical Formula: C26H24N2O4

Physical State: Dry powder
Available Amount: 2395 mg

Lipinsky:
logP: 4.049
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 6

     

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