UCSF

ZINC08873713

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2007 17 Yes

Other Names:

MFCD08064770

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) 0.65 4.83 -8.64 1 4 0 69 227.267 3

Vendor Notes

Note Type Comments Provided By
melting_point 54 - 56 KeyOrganics

Activity (Go SEA)

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