UCSF

ZINC65539961

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 24 No

Popular Name: (5R)-3-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]-7-thia-3-azaspiro[4.4]nonane-2,4-dione (5R)-3-[[methyl-[2-(3-methylphen…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.97 6.98 -11.5 0 5 0 50 348.468 6 ↓
Lo Low (pH 4.5-6) 1.97 9.46 -41.57 1 5 1 51 349.476 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.