UCSF

ZINC36103392

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 22 Yes

Popular Name: (2-bromophenyl)-[4-(morpholinomethyl)-1-piperidyl]methanone (2-bromophenyl)-[4-(morpholinome…

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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) 2.31 6.47 -10.32 0 4 0 33 367.287 3 ↓
Mid Mid (pH 6-8) 2.31 8.47 -47.76 1 4 1 34 368.295 3 ↓

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Rings

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

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