UCSF

ZINC41528729

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 24 Yes

Popular Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-methyl-benzamide N-[4-(3,4-dihydro-1H-isoquinolin…

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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) 3.54 11.15 -47.63 2 3 1 34 323.46 6 ↓
Mid Mid (pH 6-8) 3.54 8.88 -10.7 1 3 0 32 322.452 6 ↓

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

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