UCSF

ZINC05702241

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2006 23 Yes

Other Names:

MFCD04125885

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) 0.35 -0.46 -48.64 3 5 0 86 319.332 7

Vendor Notes

Note Type Comments Provided By
melting_point 227 - 228 KeyOrganics

Activity (Go SEA)

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