UCSF

ZINC01532513

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 21 Yes

Popular Name: N-Acetylaspartylglutamic acid N-Acetylaspartylglutamic acid

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Download: MOL2 SDF SMILES Flexibase

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) -4.31 3.56 -178.51 2 10 -3 179 301.231 9 ↓
Lo Low (pH 4.5-6) -4.31 2.36 -118.01 3 10 -2 176 302.239 9 ↓

Activity (Go SEA)

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