UCSF

ZINC00080437

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 14 Yes

Other Names:

MFCD01034558

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) 2.55 7.55 -45.86 0 3 -1 49 193.222 5

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0239815B1 IBM Patent Data

Activity (Go SEA)

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