UCSF

ZINC03848414

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 27 Yes

Other Names:

MFCD01846277

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) 3.49 9.49 -16.36 0 7 0 71 382.445 5

Vendor Notes

Note Type Comments Provided By
mp 196 - 197 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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