UCSF

ZINC40163233

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 30th, 2010 38 No

Popular Name: (2R)-4-amino-N-[(1S,2S,3R,4R,5R)-5-amino-4-[(2S,3S,6S)-3-amino-6-(aminomethyl)tetrahydropyran-2-yl]o (2R)-4-amino-N-[(1S,2S,3R,4R,5R)…

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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) -5.83 -14.98 -423.8 21 16 5 305 557.666 10 ↓
Hi High (pH 8-9.5) -5.83 -15.74 -197.16 19 16 3 302 555.65 10 ↓
Hi High (pH 8-9.5) -5.83 -15.61 -105.87 18 16 2 301 554.642 10 ↓
Hi High (pH 8-9.5) -5.83 -15.32 -179.85 19 16 3 302 555.65 10 ↓
Mid Mid (pH 6-8) -5.83 -15.4 -298.31 20 16 4 304 556.658 10 ↓

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