UCSF

ZINC65528639

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 23 No

Popular Name: N-[[2-(3-methoxyphenyl)-1,3-dihydropyrazol-4-yl]methyl]-N-methyl-1-[(4R)-4-methyl-4H-imidazol-5-yl]m N-[[2-(3-methoxyphenyl)-1,3-dihy…

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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) 1.69 6.3 -37.37 3 6 1 58 314.413 6 ↓
Mid Mid (pH 6-8) 1.69 5.54 -12.46 2 6 0 56 313.405 6 ↓
Lo Low (pH 4.5-6) 1.69 8.14 -48.93 3 6 1 58 314.413 6 ↓

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

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