UCSF

ZINC34944342

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Substance Information

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

Popular Name: (4E,5S)-5-(3,4-dimethoxyphenyl)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)pyrr (4E,5S)-5-(3,4-dimethoxyphenyl)-…

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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) 2.73 7.63 -46.81 0 8 -1 91 479.553 8 ↓
Mid Mid (pH 6-8) 2.73 9.9 -57.78 1 8 0 93 480.561 8 ↓
Lo Low (pH 4.5-6) 2.73 9.15 -50.72 2 8 1 90 481.569 8 ↓

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