UCSF

ZINC60321465

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 18th, 2011 35 No

Popular Name: 2-[2-[(3S)-3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-6-(tr 2-[2-[(3S)-3-(3,4-dimethoxypheny…

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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) 4.86 7.18 -48.16 0 8 -1 100 523.538 8 ↓
Lo Low (pH 4.5-6) 4.40 9 -14.12 1 8 0 97 524.546 8 ↓

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

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