UCSF

ZINC03678394

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 15 Yes

Popular Name: ethyl 3-amino-3-(3-chlorophenyl)propanoate ethyl 3-amino-3-(3-chlorophenyl)…

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CAS Numbers: 188815-45-4 , 498581-88-7

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) 0.28 5.54 -43.71 3 3 1 54 228.699 5 ↓

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