UCSF

ZINC00374248

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 13 No

Popular Name: 2-Amino-1-(4-nitrophenyl)ethanol 2-Amino-1-(4-nitrophenyl)ethanol

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CAS Numbers: 129894-63-9 , 16428-47-0 , 68215-44-1

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) -0.11 0.88 -58.44 4 5 1 94 183.187 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 130 - 132 Enamine Building Blocks
MP 130...132 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
MP 98 - 100 Enamine Building Blocks
MP 98...100 Enamine Building Blocks

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