UCSF

ZINC39500226

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 29 No

Popular Name: N-methyl-N-[[(5S)-5-(m-tolyl)-2-(p-tolyl)-1,5-dihydropyrazol-4-yl]methyl]-2-(3H-pyrazol-4-yl)ethanam N-methyl-N-[[(5S)-5-(m-tolyl)-2-…

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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) 4.38 11.36 -46.3 2 5 1 44 388.539 7 ↓
Hi High (pH 8-9.5) 4.38 8.94 -7.48 1 5 0 43 387.531 7 ↓

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

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