UCSF

ZINC04024481

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 16 No

Other Names:

MFCD00138990

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) 1.75 7.33 -10.23 0 6 0 66 238.272 2

Vendor Notes

Note Type Comments Provided By
melting_point 157 - 158 KeyOrganics

Activity (Go SEA)

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