UCSF

ZINC20404809

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 22 Yes

Other Names:

MFCD01936440

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) 2.51 7.59 -9.1 0 5 0 46 297.358 4

Vendor Notes

Note Type Comments Provided By
melting_point 98 - 100 KeyOrganics

Activity (Go SEA)

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