UCSF

ZINC02567161

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 Yes

Popular Name: amino(4-isopropylphenyl)acetic acid amino(4-isopropylphenyl)acetic acid

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CAS Numbers: 126746-20-1 , 168393-61-1

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) 0.19 4.27 -40.11 3 3 0 68 193.246 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 218 - 220 KeyOrganics

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