UCSF

ZINC41314028

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 28 Yes

Popular Name: [(11bS)-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-2-yl]-[3-(4-methylthiazol-2-yl)phenyl]meth [(11bS)-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) 3.42 9.33 -9.05 0 4 0 36 389.524 2 ↓
Mid Mid (pH 6-8) 3.42 11.46 -44.39 1 4 1 38 390.532 2 ↓

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

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