UCSF

ZINC65534892

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 29 No

Popular Name: 3-[1-[[(3R,5S)-3-(o-tolyl)-1,2,4-oxadiazolidin-5-yl]methyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimid 3-[1-[[(3R,5S)-3-(o-tolyl)-1,2,4…

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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) 2.89 5.92 -45.91 4 7 1 76 392.483 4 ↓
Mid Mid (pH 6-8) 2.89 3.38 -11.98 3 7 0 74 391.475 4 ↓

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

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