UCSF

ZINC13277969

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 34 No

Popular Name: 2-[4-[(2S)-3-(cyclopropanecarbonyl)-4-hydroxy-2-[(2R)-5-methoxy-2-methyl-2,3-dihydrobenzofuran-6-yl] 2-[4-[(2S)-3-(cyclopropanecarbon…

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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) 2.77 11.66 -111.92 0 8 -2 119 461.47 7 ↓
Mid Mid (pH 6-8) 2.18 11.06 -56.52 0 8 -1 113 462.478 7 ↓
Mid Mid (pH 6-8) 2.77 10.09 -70.49 1 8 -1 116 462.478 6 ↓

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

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