COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004331
Chemical Name: (3E,8xi,14xi,17xi)-3-(2-carbamothioylhydrazinylidene)-14-hydroxycard-20(22)-enolide
Smiles: NC(=S)N/N=C/1\CC[C@]2(C(C1)CCC1[C@@H]2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)C

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Molecular Weight: 445.63
Empirical Formula: C24H35N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.883
Rotatable bonds: 2
H-donors: 4
H-acceptors: 3
PSA: 129
Number of rings: 5

     

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