UCSF

ZINC71575633

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 29 Yes

Popular Name: [(3S)-1-(1-furo[3,2-c]pyridin-4-yl-4-piperidyl)-3-piperidyl]-morpholino-methanone [(3S)-1-(1-furo[3,2-c]pyridin-4-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.78 8.77 -49.56 1 7 1 63 399.515 3 ↓
Hi High (pH 8-9.5) 1.78 6.37 -12.76 0 7 0 62 398.507 3 ↓
Mid Mid (pH 6-8) 1.78 9.23 -104.84 2 7 2 64 400.523 3 ↓

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

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