UCSF

ZINC42132266

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 23 Yes

Popular Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-2-[methyl-[(5-methylisoxazol-3-yl)methyl]amino]acetamide N-[(1S)-1-(4-fluorophenyl)ethyl]…

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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) 2.16 8.86 -48.27 1 5 1 51 320.388 6 ↓
Hi High (pH 8-9.5) 2.16 6.6 -15.36 0 5 0 50 319.38 6 ↓

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

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