UCSF

ZINC67523355

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 29 No

Popular Name: (2S)-2-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(3-fluoro-4-imidazol-1-yl-pheny (2S)-2-[(3aS,7aR)-1,3-dioxo-3a,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) 1.47 9.63 -16.45 1 7 0 84 398.438 5 ↓
Lo Low (pH 4.5-6) 1.47 10.02 -41.35 2 7 1 86 399.446 5 ↓

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

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