UCSF

ZINC67935248

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 26 Yes

Popular Name: 5-[3-(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)-1,2,4-oxadiazol-5-yl]-1,3-dihydrobenzimidaz 5-[3-(3-methyl-5,6,7,8-tetrahydr…

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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) 1.50 3.49 -55.14 4 8 1 117 349.374 2 ↓
Mid Mid (pH 6-8) 1.50 0.73 -13.44 3 8 0 112 348.366 2 ↓
Mid Mid (pH 6-8) 1.50 1.14 -43.03 4 8 1 114 349.374 2 ↓
Mid Mid (pH 6-8) 1.50 3.92 -115.23 5 8 2 118 350.382 2 ↓

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Rings

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

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