UCSF

ZINC26895907

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 20 Yes

Other Names:

MFCD05663991

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) 3.29 7.4 -66.53 1 4 -1 65 266.276 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0687249A1; WO1994020062A2 IBM Patent Data

Activity (Go SEA)

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