UCSF

ZINC66148738

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 33 No

Popular Name: 2,2,2-trifluoro-N-[(R)-[(1S)-2-phenylcyclohept-2-en-1-yl]-(3,4,5-trimethoxyphenyl)methyl]acetamide 2,2,2-trifluoro-N-[(R)-[(1S)-2-p…

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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) 5.43 10.79 -10.54 1 5 0 57 463.496 8 ↓
Hi High (pH 8-9.5) 5.62 9.08 -35.14 0 5 -1 63 462.488 8 ↓

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

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