UCSF

ZINC02014752

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 18 Yes

Popular Name: 2-(phenethylamino)-1-phenyl-1-ethanol 2-(phenethylamino)-1-phenyl-1-et…

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CAS Number: 4164-20-9

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) 2.36 6.69 -44.98 3 2 1 37 242.342 6 ↓
Hi High (pH 8-9.5) 2.36 5.29 -4.49 2 2 0 32 241.334 6 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 90 - 91 KeyOrganics

Activity (Go SEA)

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