UCSF

ZINC66423119

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 29 Yes

Popular Name: 2-fluoro-N-[2-[4-[3-(o-tolyl)propanoyl]piperazin-1-yl]ethyl]benzamide 2-fluoro-N-[2-[4-[3-(o-tolyl)pro…

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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) 3.21 8.53 -19.59 1 5 0 53 397.494 7 ↓
Lo Low (pH 4.5-6) 3.21 10.74 -61.08 2 5 1 54 398.502 7 ↓

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

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