UCSF

ZINC69664805

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2011 21 Yes

Popular Name: 2-isopropyl-1-methyl-5-[(1S)-1-(3-pyridyl)ethyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine 2-isopropyl-1-methyl-5-[(1S)-1-(…

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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) 2.18 7.85 -27.15 1 4 1 35 285.415 3 ↓
Mid Mid (pH 6-8) 2.18 9.8 -96.1 2 4 2 36 286.423 3 ↓
Lo Low (pH 4.5-6) 2.18 9.22 -37.6 1 4 1 35 285.415 3 ↓

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

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