UCSF

ZINC67982094

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2011 24 Yes

Popular Name: (1,9-dimethyl-1,4,9-triazaspiro[5.5]undecan-4-yl)-(2-ethoxy-3-pyridyl)methanone (1,9-dimethyl-1,4,9-triazaspiro[…

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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) 0.77 5.66 -45.47 1 6 1 50 333.456 3 ↓
Lo Low (pH 4.5-6) 0.77 6.84 -113.36 2 6 2 51 334.464 3 ↓

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

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