UCSF

ZINC65494809

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 25 Yes

Popular Name: (9aR)-8-methyl-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazin (9aR)-8-methyl-2-[[4-(pyrazol-1-…

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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) 0.88 5.07 -11.59 0 6 0 45 339.443 4 ↓
Mid Mid (pH 6-8) 0.88 7.34 -40.87 1 6 1 46 340.451 4 ↓

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

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