UCSF

ZINC53345108

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 19 Yes

Popular Name: N'-benzyl-N'-methyl-N-[(1S)-1-[(2S)-tetrahydrofuran-2-yl]ethyl]ethane-1,2-diamine N'-benzyl-N'-methyl-N-[(1S)-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) 2.23 8.21 -117.54 3 3 2 30 264.413 7 ↓
Hi High (pH 8-9.5) 2.23 6.95 -37.9 2 3 1 26 263.405 7 ↓
Mid Mid (pH 6-8) 2.23 5.89 -36.87 2 3 1 29 263.405 7 ↓

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

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