COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK713211
Chemical Name: 3-[5-chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6-oxopyridazin-1(6H)-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxylicacid
Smiles: COc1cc(CCNc2cnn(c(=O)c2Cl)C23CC4CC(C2)CC(C3)(C4)C(=O)O)ccc1OC

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Molecular Weight: 487.98
Empirical Formula: C25H30ClN3O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.587
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 6

     

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