UCSF

ZINC38019272

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 20 No

Popular Name: 3-methyl-N-[[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]-5-nitro-imidazol-4-amine 3-methyl-N-[[(1R,5S)-8-methyl-8-…

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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) 1.24 9.37 -54.27 2 7 1 80 280.352 4 ↓
Mid Mid (pH 6-8) 1.24 9.47 -112.14 3 7 2 85 281.36 4 ↓
Lo Low (pH 4.5-6) 1.24 9.84 -95.07 3 7 2 81 281.36 4 ↓

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

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