UCSF

ZINC53929836

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2010 20 Yes

Popular Name: (2S,4S)-2-[[[(1S)-1-cyclopropylethyl]-(2-methoxyethyl)amino]methyl]-4-ethyl-cyclohexanone (2S,4S)-2-[[[(1S)-1-cyclopropyle…

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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) 3.17 9.11 -35.24 1 3 1 31 282.448 8 ↓
Hi High (pH 8-9.5) 3.17 7.08 -7.5 0 3 0 30 281.44 8 ↓

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

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