UCSF

ZINC69483780

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 24 Yes

Popular Name: 4-[(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-2-(1-methylpyrazol-4-yl)thiazole 4-[(1-cyclopropyl-6,7-dihydro-4H…

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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) 1.55 8.21 -31.41 1 6 1 53 341.464 4 ↓
Hi High (pH 8-9.5) 1.55 7.74 -16.43 0 6 0 52 340.456 4 ↓
Mid Mid (pH 6-8) 1.55 10.46 -96.35 2 6 2 54 342.472 4 ↓

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

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