COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446804
Chemical Name: 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2

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Molecular Weight: 414.53
Empirical Formula: C22H26N2O4S

Physical State: Dry powder
Available Amount: 800 mg

Lipinsky:
logP: 6.444
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 118
Number of rings: 3

     

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