UCSF

ZINC34940902

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 35 No

Popular Name: (4E,5S)-4-[(3-ethoxyphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)-5-(3-nitrophenyl)pyrrolidine-2, (4E,5S)-4-[(3-ethoxyphenyl)-hydr…

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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) 2.60 7.89 -56.17 0 10 -1 128 480.497 9 ↓
Mid Mid (pH 6-8) 2.60 10.16 -74.81 1 10 0 129 481.505 9 ↓
Lo Low (pH 4.5-6) 2.60 9.4 -63.55 2 10 1 126 482.513 9 ↓

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