UCSF

ZINC58307285

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 22 Yes

Popular Name: (1S)-1-(2,4-difluorophenyl)-2-[[(6R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino]eth (1S)-1-(2,4-difluorophenyl)-2-[[…

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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) 1.10 3.76 -59.1 4 5 1 67 309.34 5 ↓
Hi High (pH 8-9.5) 1.10 2.42 -10.7 3 5 0 62 308.332 5 ↓
Mid Mid (pH 6-8) 1.10 3.92 -103.35 5 5 2 68 310.348 5 ↓

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

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