UCSF

ZINC14768526

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2008 23 No

Popular Name: 2,3-didehydro-2,4-dideoxy-4-guanidino-N-acetyl-D-neuraminic acid; 2,3-didehydro-2,4-dideoxy-4-guanidinyl-N-acetylneuraminic acid; 4-Guanidino-2,4-dideoxy-2,3-dehydro-N-acetylneuraminic acid; 4-guanidino-2,4-dideoxy-2,3-didehydro-N-acetylneuraminic acid; 4 2,3-didehydro-2,4-dideoxy-4-guan…

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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) -3.51 -4.19 -60.46 9 11 0 203 332.313 7 ↓
Lo Low (pH 4.5-6) -3.51 -6.39 -43.2 10 11 1 200 333.321 7 ↓

Activity (Go SEA)

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