COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134104
Chemical Name: 9-{2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-2-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
Smiles: OCCN1CCN(CC1)CC(Cn1c2ccccc2c2c1C(=O)N(C)CC2)O

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Saltdata: 2HCI
Molecular Weight: 386.49
Empirical Formula: C21H30N4O3

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 0.051
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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