UCSF

ZINC36145817

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 32 No

Popular Name: (2S)-1-[(2,4-difluorophenyl)methyl-[[(5R)-3-(o-tolyl)-4,5-dihydroisoxazol-5-yl]methyl]amino]-3-isobu (2S)-1-[(2,4-difluorophenyl)meth…

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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) 4.47 10.91 -42.45 2 5 1 55 447.546 11 ↓
Hi High (pH 8-9.5) 4.47 8.79 -9.24 1 5 0 54 446.538 11 ↓

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