COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL451996
Chemical Name: 4-(3,4-dimethoxyphenyl)-N-ethyl-1-(phenoxymethyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCNC(=S)c1n2nc(n3c2c(c1c1ccc(c(c1)OC)OC)CCCC3)COc1ccccc1

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Molecular Weight: 490.63
Empirical Formula: C27H30N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.843
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 5

     

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