UCSF

ZINC36125824

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 25 Yes

Popular Name: [(11bR)-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-2-yl]-(2,3,4-trifluorophenyl)methanone [(11bR)-1,3,4,6,7,11b-hexahydrop…

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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) 2.72 7.98 -14.19 0 3 0 24 346.352 1 ↓
Mid Mid (pH 6-8) 2.72 10.11 -53.91 1 3 1 25 347.36 1 ↓

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

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