UCSF

ZINC08743770

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 35 No

Popular Name: 5-(3,4-dimethoxyphenyl)-4-[hydroxy-(4-isopropoxyphenyl)-methylene]-1-(5-methylisoxazol-3-yl)-pyrroli 5-(3,4-dimethoxyphenyl)-4-[hydro…

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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) 3.35 10.07 -65.42 0 9 -1 114 477.493 8 ↓
Mid Mid (pH 6-8) 3.79 8.88 -26.03 1 9 0 111 478.501 7 ↓
Mid Mid (pH 6-8) 2.76 10.35 -17.61 0 9 0 108 478.501 8 ↓

Activity (Go SEA)

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