UCSF

ZINC09302132

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 37 No

Popular Name: 1-(3-dimethylaminopropyl)-4-[hydroxy-(4-propoxyphenyl)-methylene]-5-(3,4,5-trimethoxyphenyl)-pyrroli 1-(3-dimethylaminopropyl)-4-[hyd…

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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) 3.25 10.44 -72.74 1 9 0 102 512.603 13 ↓
Mid Mid (pH 6-8) 3.69 9.92 -48.11 2 9 1 99 513.611 12 ↓
Mid Mid (pH 6-8) 2.66 2.05 -52.32 1 9 1 95 513.611 13 ↓

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