UCSF

ZINC69847139

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 23 Yes

Popular Name: (2S)-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-3,3-dimethyl-butan-2-ol (2S)-1-[4-(imidazo[1,2-a]pyridin…

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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) 2.29 4.82 -27.65 2 5 1 45 317.457 5 ↓
Hi High (pH 8-9.5) 2.29 4.09 -10.21 1 5 0 44 316.449 5 ↓
Mid Mid (pH 6-8) 2.29 7.15 -81.38 3 5 2 46 318.465 5 ↓

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

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