UCSF

ZINC62321132

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 21 No

Popular Name: 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N-methyl-4-nitro-aniline 2-(6,8-dihydro-5H-imidazo[1,2-a]…

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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) 0.91 6.09 -36.57 2 7 1 80 288.331 4 ↓
Hi High (pH 8-9.5) 0.91 5.62 -16.27 1 7 0 79 287.323 4 ↓
Lo Low (pH 4.5-6) 0.91 8.44 -120.1 3 7 2 81 289.339 4 ↓

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

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