UCSF

ZINC37239740

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 20 Yes

Popular Name: (1R)-1-(1,3-benzothiazol-2-yl)-N-ethyl-2-(1-methylpyrazol-4-yl)ethanamine (1R)-1-(1,3-benzothiazol-2-yl)-N…

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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) 2.40 6.82 -36.51 2 4 1 47 287.412 5 ↓
Mid Mid (pH 6-8) 2.40 5.89 -9.35 1 4 0 43 286.404 5 ↓

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

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