UCSF

ZINC01676317

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 Yes

Popular Name: benzoic acid, 2-(1-oxopropoxy)- benzoic acid, 2-(1-oxopropoxy)-

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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) 2.10 2.45 -57.11 0 4 -1 66 193.178 4 ↓

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