UCSF

ZINC62960082

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 20 Yes

Popular Name: [5-(8-azaspiro[4.5]decan-8-ylsulfonyl)-2-thienyl]methanamine [5-(8-azaspiro[4.5]decan-8-ylsul…

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Download: MOL2 SDF SMILES Flexibase

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) 2.51 3.79 -55.65 3 4 1 65 315.484 3 ↓
Hi High (pH 8-9.5) 2.51 3.4 -8.93 2 4 0 63 314.476 3 ↓

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

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