UCSF

ZINC57911029

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 28 Yes

Popular Name: (2R)-N-[3-[[[2-[4-(2,2-difluoroethyl)piperazin-1-yl]acetyl]amino]methyl]phenyl]-2-methyl-butanamide (2R)-N-[3-[[[2-[4-(2,2-difluoroe…

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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) 2.59 4.36 -16.22 2 6 0 65 396.482 9 ↓
Lo Low (pH 4.5-6) 2.59 6.48 -40.73 3 6 1 66 397.49 9 ↓

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

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