UCSF

ZINC06338062

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2006 18 No

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) 4.92 1.98 -8.86 0 1 0 17 277.15 3

Vendor Notes

Note Type Comments Provided By
melting_point 79 - 81 KeyOrganics

Activity (Go SEA)

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