UCSF

ZINC22754497

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 25 Yes

Popular Name: 2-benzo[e]benzofuran-1-yl-N-[(2R)-2-dimethylamino-3-methyl-butyl]acetamide 2-benzo[e]benzofuran-1-yl-N-[(2R…

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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) 3.78 9.9 -53.56 2 4 1 47 339.459 6 ↓
Hi High (pH 8-9.5) 3.78 7.54 -14 1 4 0 45 338.451 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.