UCSF

ZINC66180371

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 26 Yes

Popular Name: benzenemethanamine, N-[(4-fluorophenyl)methyl]-4-(2-phenoxyethoxy)- benzenemethanamine, N-[(4-fluoro…

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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) 4.80 11.36 -54.38 2 3 1 35 352.429 9 ↓
Hi High (pH 8-9.5) 4.80 10.01 -8.88 1 3 0 30 351.421 9 ↓

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

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