UCSF

ZINC35297525

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 36 No

Popular Name: (4E,5S)-4-[(3-ethoxyphenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(4-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) 2.89 8.66 -58.99 0 10 -1 128 494.524 10 ↓
Mid Mid (pH 6-8) 2.89 10.92 -82.5 1 10 0 129 495.532 10 ↓
Lo Low (pH 4.5-6) 2.89 10.17 -66.3 2 10 1 126 496.54 10 ↓

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