UCSF

ZINC55036622

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 26 Yes

Popular Name: 1'-[(1-allyl-3-methyl-pyrazol-4-yl)methyl]spiro[1,4-dihydroquinoxaline-3,4'-piperidine]-2-one 1'-[(1-allyl-3-methyl-pyrazol-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) 1.92 7.66 -49.41 3 6 1 63 352.462 4 ↓
Mid Mid (pH 6-8) 1.92 5.42 -11.17 2 6 0 62 351.454 4 ↓

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

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