UCSF

ZINC67235631

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 35 Yes

Popular Name: 3-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-7-(3-methoxyphenyl)-5-methyl-pyrrolo[3,2-d]pyri 3-[2-[4-(2-fluorophenyl)piperazi…

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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) 3.89 13.02 -22.32 0 8 0 73 475.524 5 ↓

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Rings

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

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