COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598205
Chemical Name: S-benzyl-N-[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-cysteinyl-beta-alanine
Smiles: O=C(N[C@@H](C(=O)NCCC(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C

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Molecular Weight: 550.63
Empirical Formula: C29H30N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.782
Rotatable bonds: 11
H-donors: 3
H-acceptors: 7
PSA: 160
Number of rings: 4

     

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