UCSF

ZINC62319582

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 20 Yes

Popular Name: (2R)-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(isopropylamino)-2-methyl-pentanenitrile (2R)-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) 0.98 4.87 -29.89 2 5 1 58 276.408 6 ↓
Hi High (pH 8-9.5) 0.98 4.41 -12.78 1 5 0 57 275.4 6 ↓
Mid Mid (pH 6-8) 0.98 5.72 -84.2 3 5 2 63 277.416 6 ↓

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

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