UCSF

ZINC58563726

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2011 31 Yes

Popular Name: 2-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-6-[(2R,3S)-2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-3,5-di 2-[5-(2-fluorophenyl)-1H-pyrazol…

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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) 2.94 4.75 -43.02 4 7 1 92 428.484 6 ↓
Mid Mid (pH 6-8) 2.94 5.5 -46.58 3 7 0 95 427.476 6 ↓

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

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