COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042606
Chemical Name: (3s,5s,7s)-N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)C23C[C@@H]4C[C@H](C3)C[C@H](C2)C4)/s1

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Molecular Weight: 399.51
Empirical Formula: C21H25N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.716
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 6

     

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