UCSF

ZINC52380560

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2010 20 Yes

Popular Name: N-[[1-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethyl]triazol-4-yl]methyl]propan-2-amine N-[[1-[2-[(2R,6R)-2,6-dimethylmo…

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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) 0.93 3.37 -42.89 2 6 1 60 282.412 6 ↓
Hi High (pH 8-9.5) 0.93 2.18 -9.82 1 6 0 55 281.404 6 ↓
Mid Mid (pH 6-8) 0.93 5.32 -96.91 3 6 2 61 283.42 6 ↓

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

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