UCSF

ZINC05719564

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2006 18 Yes

Popular Name: 4-Dibenzofuranol, 3-((dimethylamino)methyl)-6,7,8,9-tetrahydro-, hydrochloride; 4-Dibenzofuranol, 6,7,8,9-tetrahydro-3-((dimethylamino)methyl)-, hydrochloride; 6,7,8,9-Tetrahydro-3-((dimethylamino)methyl)-4-dibenzofuranol hydrochloride; LS-61087 4-Dibenzofuranol, 3-((dimethylam…

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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) 2.93 6.84 -38.22 2 3 1 38 246.33 2 ↓
Hi High (pH 8-9.5) 2.93 4.34 -7.24 1 3 0 37 245.322 2 ↓
Hi High (pH 8-9.5) 2.93 7.59 -36.64 1 3 0 41 245.322 2 ↓

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