UCSF

ZINC02510052

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Substance Information

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

Popular Name: [(2S)-2-hydroxy-2-(p-tolyl)ethyl]-isopropyl-ammonium [(2S)-2-hydroxy-2-(p-tolyl)ethyl…

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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) 2.03 4.18 -37.27 3 2 1 37 194.298 4 ↓

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