UCSF

ZINC05819025

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2006 14 No

Other Names:

MFCD00297072

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) 1.56 6.44 -11.66 1 5 0 75 189.174 2
Ref Reference (pH 7) 1.56 6.39 -10.34 1 5 0 75 189.174 2
Lo Low (pH 4.5-6) 1.56 6.9 -49.08 2 5 1 76 190.182 2
Lo Low (pH 4.5-6) 1.56 6.91 -49.09 2 5 1 76 190.182 2

Vendor Notes

Note Type Comments Provided By
MP 224 - 226 Enamine Building Blocks
MP 224...226 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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