UCSF

ZINC48947553

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 21 Yes

Popular Name: (1R)-1-(2,5-dimethoxyphenyl)-N'-methyl-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1R)-1-(2,5-dimethoxyphenyl)-N'-…

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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) -0.13 2.9 -39.3 3 5 1 59 295.403 7 ↓
Hi High (pH 8-9.5) -0.13 2.24 -5.63 2 5 0 57 294.395 7 ↓
Mid Mid (pH 6-8) -0.13 4.92 -121.7 4 5 2 60 296.411 7 ↓

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

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