UCSF

ZINC65535030

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 26 Yes

Popular Name: (2S)-2-[(4S,5R)-5-[(2R)-4-methyl-2H-imidazol-2-yl]-4-phenyl-imidazolidin-1-yl]-2-phenyl-ethanol (2S)-2-[(4S,5R)-5-[(2R)-4-methyl…

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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) 2.41 4.11 -28.93 4 5 1 65 349.458 5 ↓
Hi High (pH 8-9.5) 2.41 3.71 -10.34 3 5 0 64 348.45 5 ↓
Lo Low (pH 4.5-6) 2.41 5.5 -102.76 5 5 2 70 350.466 5 ↓
Lo Low (pH 4.5-6) 2.41 6.11 -98.38 5 5 2 67 350.466 5 ↓

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

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