UCSF

ZINC33813356

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 32 No

Popular Name: (2R)-1-(2-diethylaminoethyl)-4-hydroxy-3-(5-methylbenzofuran-2-carbonyl)-2-(3-pyridyl)-2H-pyrrol-5-o (2R)-1-(2-diethylaminoethyl)-4-h…

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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) 2.91 10.75 -67.34 1 7 0 91 433.508 8 ↓
Hi High (pH 8-9.5) 2.91 7.66 -60.39 0 7 -1 90 432.5 8 ↓
Lo Low (pH 4.5-6) 2.91 9.18 -45.3 2 7 1 88 434.516 8 ↓

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