UCSF

ZINC62954317

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Substance Information

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

Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-4,6-dimethyl-pyridine-3-carboxamidine 2-(8-azaspiro[4.5]decan-8-yl)-4,…

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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) 2.18 6.83 -34.36 4 4 1 68 287.431 2 ↓
Hi High (pH 8-9.5) 2.18 6.87 -5.86 3 4 0 66 286.423 2 ↓
Mid Mid (pH 6-8) 2.18 7.25 -88.96 5 4 2 69 288.439 2 ↓

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

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