UCSF

ZINC43965835

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2010 20 Yes

Popular Name: (1S)-1-(4-methoxyphenyl)-N,N'-dimethyl-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1S)-1-(4-methoxyphenyl)-N,N'-di…

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Vendors

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) 2.14 6.95 -116.41 3 4 2 40 280.412 7 ↓
Hi High (pH 8-9.5) 2.14 3.31 -4.93 1 4 0 34 278.396 7 ↓
Mid Mid (pH 6-8) 2.14 5.01 -34.41 2 4 1 38 279.404 7 ↓
Mid Mid (pH 6-8) 2.14 5.81 -34.09 2 4 1 35 279.404 7 ↓

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