UCSF

ZINC18127797

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 9 No

CAS Numbers: 1728-25-2 , 286-62-4

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) 2.16 4.88 -4.92 0 1 0 17 124.183 0
Ref Reference (pH 7) 2.16 4.9 -4.64 0 1 0 17 124.183 0

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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