UCSF

ZINC34944312

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 32 No

Popular Name: (4E,5S)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-5-(4-fluorophenyl)-1-(2-morpholinoethyl)pyrrolidi (4E,5S)-4-[(2,5-dimethylphenyl)-…

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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) 3.24 8.94 -58.32 0 6 -1 73 437.491 6 ↓
Mid Mid (pH 6-8) 3.24 11.2 -72.86 1 6 0 74 438.499 6 ↓
Lo Low (pH 4.5-6) 3.24 10.31 -52.85 2 6 1 71 439.507 6 ↓

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