COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL155115
Chemical Name: methylN-({3-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetyl)-beta-alaninate
Smiles: COC(=O)CCNC(=O)Cn1nc(ccc1=O)N1CCN(CC1)c1cccc(c1)Cl

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Molecular Weight: 433.89
Empirical Formula: C20H24ClN5O4

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: -0.16
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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