COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623648
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Smiles: COc1cc(CCNC(=O)c2nn(c3c2CCCC3)C2CCS(=O)(=O)C2)ccc1OC

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Molecular Weight: 447.56
Empirical Formula: C22H29N3O5S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 0.933
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 4

     

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