UCSF

ZINC35296231

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 33 No

Popular Name: (4E,5S)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3,4-dichlorophenyl)-1-(2-dimethylaminoethyl)pyrrol (4E,5S)-4-[(3-butoxyphenyl)-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) 5.16 12.55 -72.93 1 6 0 74 491.415 10 ↓
Lo Low (pH 4.5-6) 5.16 11.79 -56.86 2 6 1 71 492.423 10 ↓

Activity (Go SEA)

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