UCSF

ZINC67447301

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 25 Yes

Popular Name: (4S)-5-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-4-(2-pyridyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyrid (4S)-5-[[1-(2-methoxyethyl)imida…

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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) 0.40 8.27 -78.84 3 7 2 74 340.431 6 ↓
Hi High (pH 8-9.5) 0.40 6.69 -9.49 1 7 0 72 338.415 6 ↓
Mid Mid (pH 6-8) 0.40 7.81 -34.08 2 7 1 73 339.423 6 ↓
Lo Low (pH 4.5-6) 0.40 7.83 -165.32 4 7 3 76 341.439 6 ↓

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Rings

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

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