UCSF

ZINC05763635

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 22 Yes

Other Names:

MFCD01814452

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) 4.50 10.38 -51.49 0 4 -1 58 332.166 3

Vendor Notes

Note Type Comments Provided By
melting_point 119 - 120 KeyOrganics

Activity (Go SEA)

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