UCSF

ZINC69134842

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2011 18 Yes

Popular Name: (2S,6S)-1-[[(3R)-1,4-dioxaspiro[4.4]nonan-3-yl]methyl]-2,6-dimethyl-piperazine (2S,6S)-1-[[(3R)-1,4-dioxaspiro[…

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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) 1.57 3.35 -38.94 2 4 1 38 255.382 2 ↓
Hi High (pH 8-9.5) 1.57 2.18 -3.54 1 4 0 34 254.374 2 ↓

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

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