UCSF

ZINC54895563

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 20 Yes

Popular Name: (7R)-2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-5,5-dimethyl-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7R)-2-[(2S,5R)-2,5-dimethylmorp…

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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) 1.07 5.57 -45.49 3 4 1 53 296.46 1 ↓
Hi High (pH 8-9.5) 1.07 5.24 -5.3 2 4 0 51 295.452 1 ↓
Mid Mid (pH 6-8) 1.07 4.67 -23.02 3 4 1 53 296.46 1 ↓
Mid Mid (pH 6-8) 1.07 5.01 -100.11 4 4 2 54 297.468 1 ↓

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

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