UCSF

ZINC64313602

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 17th, 2011 28 Yes

Popular Name: 2-(2-dimethylaminoethyloxy)-N-[[(3S)-1-(4-fluorophenyl)pyrrolidin-3-yl]methyl]benzamide 2-(2-dimethylaminoethyloxy)-N-[[…

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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) 4.11 11.2 -38.22 2 5 1 46 386.491 8 ↓
Hi High (pH 8-9.5) 4.11 8.75 -14.08 1 5 0 45 385.483 8 ↓

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

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