UCSF

ZINC39500068

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 28 No

Popular Name: N-[[(5S)-5-(2-chlorophenyl)-2-(4-fluorophenyl)-1,5-dihydropyrazol-4-yl]methyl]-N-methyl-1-(1H-pyrazo N-[[(5S)-5-(2-chlorophenyl)-2-(4…

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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) 4.20 11.13 -34.77 3 5 1 48 398.893 6 ↓
Hi High (pH 8-9.5) 4.20 8.88 -7.29 2 5 0 47 397.885 6 ↓

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

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