UCSF

ZINC62580490

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 21 No

Popular Name: 3-[[(5-bromo-3-thienyl)methyl-methyl-amino]methyl]-3-azaspiro[4.4]nonane-2,4-dione 3-[[(5-bromo-3-thienyl)methyl-me…

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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) 2.54 6.57 -7.75 0 4 0 41 371.3 4 ↓
Lo Low (pH 4.5-6) 2.54 8.99 -38.83 1 4 1 42 372.308 4 ↓

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

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