COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK637080
Chemical Name: methyl2-{[8-(4-chlorophenyl)-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidin-6-yl]sulfanyl}butanoate
Smiles: CCC(C(=O)OC)Sc1nc2n(ncc2c2=NCCCn12)c1ccc(cc1)Cl

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Molecular Weight: 417.92
Empirical Formula: C19H20ClN5O2S

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 3.078
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 4

     

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