COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539833
Chemical Name: (1S,3aS,3bR,5aS,13aS,13bS,15aS)-1,13a,15a-trimethyl-2,3,3a,3b,4,5,5a,6,13,13a,13b,14,15,15a-tetradecahydro-1H-cyclopenta[5,6]naphtho[1,2-g]tetrazolo[1,5-a]quinazolin-1-ol
Smiles: C[C@]12Cc3cnc4n(c3C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]2(C)O)C)nnn4

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Molecular Weight: 381.52
Empirical Formula: C22H31N5O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.165
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 76
Number of rings: 6

     

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