UCSF

ZINC37105590

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 20 Yes

Popular Name: N-[(1R,2S)-2-methylcyclohexyl]-2-(pyrrolidin-1-ylmethyl)aniline N-[(1R,2S)-2-methylcyclohexyl]-2…

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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) 4.77 11.07 -32.49 2 2 1 16 273.444 4 ↓

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Rings

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

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