UCSF

ZINC65503723

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 26 Yes

Popular Name: (4R)-4-[(4S,5S)-5-phenyl-3-(2-pyrrolidin-1-ylsulfonylethyl)imidazolidin-4-yl]-4H-imidazole (4R)-4-[(4S,5S)-5-phenyl-3-(2-py…

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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) 1.18 3.63 -41.02 3 7 1 83 376.506 6 ↓
Hi High (pH 8-9.5) 1.18 3.59 -13.36 2 7 0 81 375.498 6 ↓
Mid Mid (pH 6-8) 1.18 5.73 -117.87 4 7 2 84 377.514 6 ↓

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

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