UCSF

ZINC17124683

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 31 No

Popular Name: (4E,5S)-4-[hydroxy-(p-tolyl)methylene]-5-(5-methyl-2-furyl)-1-(3-morpholinopropyl)pyrrolidine-2,3-di (4E,5S)-4-[hydroxy-(p-tolyl)meth…

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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) 2.45 6.95 -62.82 0 7 -1 86 423.489 7 ↓
Mid Mid (pH 6-8) 2.90 8.23 -57.14 2 7 1 84 425.505 6 ↓
Mid Mid (pH 6-8) 2.45 9.29 -75.1 1 7 0 87 424.497 7 ↓

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