UCSF

ZINC20219822

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 38 No

Popular Name: (5R)-5-(2,5-dimethoxyphenyl)-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-1-(2-morpholinoethyl)-5H-p (5R)-5-(2,5-dimethoxyphenyl)-3-h…

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Download: MOL2 SDF SMILES Flexibase

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) 2.87 5.76 -66.44 0 10 -1 114 521.546 9 ↓
Mid Mid (pH 6-8) 2.87 8.11 -70.93 1 10 0 115 522.554 9 ↓
Lo Low (pH 4.5-6) 2.87 7.29 -48.27 2 10 1 112 523.562 9 ↓

Activity (Go SEA)

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