UCSF

ZINC67973905

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 29 Yes

Popular Name: N-[[2-(2-imidazol-1-ylethoxy)-3-methoxy-phenyl]methyl]-2-(4,5,6,7-tetrahydro-2H-indazol-3-yl)ethanam N-[[2-(2-imidazol-1-ylethoxy)-3-…

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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) 2.60 10.66 -60.04 3 7 1 82 396.515 10 ↓
Hi High (pH 8-9.5) 2.60 9.31 -12.28 2 7 0 77 395.507 10 ↓
Mid Mid (pH 6-8) 2.60 11.19 -94.37 4 7 2 83 397.523 10 ↓

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

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