UCSF

ZINC69216701

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 30 Yes

Popular Name: (2R)-1-[(2S)-2-ethyl-1-piperidyl]-2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-propan-1-one (2R)-1-[(2S)-2-ethyl-1-piperidyl…

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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) 5.78 12.76 -10.87 0 4 0 46 423.557 5 ↓

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

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