UCSF

ZINC03678211

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 14 Yes

Popular Name: 3-amino-3-(2,3-dimethylphenyl)propanoic acid 3-amino-3-(2,3-dimethylphenyl)pr…

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CAS Numbers: 1212852-63-5 , 1354970-53-8 , 412925-12-3

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) -0.26 4.14 -40.43 3 3 0 68 193.246 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 211 - 213 Enamine Building Blocks
MP 211...213 Enamine Building Blocks
MP 229 - 231 Enamine Building Blocks
MP 229...231 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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