UCSF

ZINC49509108

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 19 Yes

Popular Name: 2-[(1S)-1-methyl-2-morpholino-ethyl]isoindolin-1-imine 2-[(1S)-1-methyl-2-morpholino-et…

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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) 0.74 5.1 -27.71 2 4 1 41 260.361 3 ↓
Mid Mid (pH 6-8) 0.74 7.57 -97.51 3 4 2 42 261.369 3 ↓

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

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