UCSF

ZINC34944317

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 33 No

Popular Name: (4E,5R)-5-(3,4-dichlorophenyl)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)pyrro (4E,5R)-5-(3,4-dichlorophenyl)-4…

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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) 4.36 9.54 -54.75 0 6 -1 73 488.391 6 ↓
Mid Mid (pH 6-8) 4.36 11.81 -66.93 1 6 0 74 489.399 6 ↓
Lo Low (pH 4.5-6) 4.36 10.92 -49.28 2 6 1 71 490.407 6 ↓

Activity (Go SEA)

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