UCSF

ZINC62954498

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 21 Yes

Popular Name: (3R)-3-amino-6-(8-azaspiro[4.5]decan-8-yl)indolin-2-one (3R)-3-amino-6-(8-azaspiro[4.5]d…

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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) 0.38 4.33 -6.44 3 4 0 58 285.391 1 ↓
Mid Mid (pH 6-8) 0.38 4.64 -43.87 4 4 1 60 286.399 1 ↓
Mid Mid (pH 6-8) 0.38 5.02 -42.13 4 4 1 60 286.399 1 ↓
Lo Low (pH 4.5-6) 0.38 5.33 -103.19 5 4 2 61 287.407 1 ↓

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Rings

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

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