UCSF

ZINC54700616

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 17 Yes

Popular Name: N-[[(8S)-8-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methyl]-3-fluoro-pyridin-2-amine N-[[(8S)-8-bicyclo[4.2.0]octa-1(…

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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) 2.60 7.88 -6.11 1 2 0 25 228.27 3 ↓
Lo Low (pH 4.5-6) 2.60 8.25 -34.18 2 2 1 26 229.278 3 ↓

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Rings

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

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