UCSF

ZINC34043872

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2009 25 Yes

Popular Name: 3,3,3-trifluoro-1-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-piperidyl]pro 3,3,3-trifluoro-1-[(3S,4R)-4-met…

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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) 2.19 9.42 -20.46 1 6 0 65 355.364 4 ↓
Lo Low (pH 4.5-6) 2.19 9.88 -38.11 2 6 1 66 356.372 4 ↓

Activity (Go SEA)

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