COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL233184
Chemical Name: N-({[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetyl)-beta-alanine
Smiles: O=C(CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C)NCCC(=O)O

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Molecular Weight: 415.51
Empirical Formula: C21H25N3O4S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.376
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 126
Number of rings: 3

     

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