UCSF

ZINC37840415

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 20 Yes

Popular Name: (9aR)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine (9aR)-2-[(3,5-dimethyl-1H-pyrazo…

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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) 0.79 3.82 -44.94 2 6 1 70 299.42 2 ↓
Mid Mid (pH 6-8) 0.79 1.56 -9.34 1 6 0 69 298.412 2 ↓

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