UCSF

ZINC67434855

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 25 Yes

Popular Name: 2-[2-methoxy-4-[[(5S)-3-methyl-3,7-diazaspiro[4.5]decan-7-yl]methyl]phenoxy]acetamide 2-[2-methoxy-4-[[(5S)-3-methyl-3…

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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) 0.76 5.17 -47.17 3 6 1 69 348.467 6 ↓
Mid Mid (pH 6-8) 0.76 4.57 -54.78 3 6 1 69 348.467 6 ↓
Mid Mid (pH 6-8) 0.76 7.26 -117.37 4 6 2 70 349.475 6 ↓

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Rings

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

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