UCSF

ZINC12217688

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2008 35 Yes

Popular Name: 2-imidazol-1-yl-N-[[3-methyl-7-(5-phenoxyfuran-2-carbonyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]meth 2-imidazol-1-yl-N-[[3-methyl-7-(…

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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) 1.57 -0.15 -19.15 1 9 0 102 471.517 7 ↓
Mid Mid (pH 6-8) 1.57 0.14 -43.46 2 9 1 104 472.525 7 ↓
Lo Low (pH 4.5-6) 1.57 -0.08 -53.52 2 9 1 104 472.525 7 ↓
Lo Low (pH 4.5-6) 1.57 0.2 -90.17 3 9 2 105 473.533 7 ↓

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Rings

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

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