UCSF

ZINC62319569

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 19 Yes

Popular Name: (2S)-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methyl-pentanenitrile (2S)-5-(6,8-dihydro-5H-imidazo[1…

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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) 0.69 4.17 -34.98 2 5 1 58 262.381 6 ↓
Hi High (pH 8-9.5) 0.69 3.71 -13.21 1 5 0 57 261.373 6 ↓
Mid Mid (pH 6-8) 0.69 5.4 -88.96 3 5 2 63 263.389 6 ↓

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

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