COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL126582
Chemical Name: 3-(1,3-benzodioxol-5-yl)-7-{[2-(cyclohex-1-en-1-yl)ethyl]amino}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2nc(NCCC3=CCCCC3)ncc2c(=O)n1c1ccc2c(c1)OCO2

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Molecular Weight: 407.43
Empirical Formula: C21H21N5O4

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 2.872
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 105
Number of rings: 5

     

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