UCSF

ZINC67446754

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 26 Yes

Popular Name: 3-[(4R)-5-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-4-yl] 3-[(4R)-5-[[4-(3-hydroxyprop-1-y…

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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) 2.32 6.61 -43.42 4 5 1 74 366.466 3 ↓
Mid Mid (pH 6-8) 2.32 5.27 -41.84 4 5 1 74 366.466 3 ↓
Mid Mid (pH 6-8) 2.32 4.82 -13.17 3 5 0 72 365.458 3 ↓

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

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