UCSF

ZINC04118386

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 28 No

Other Names:

MFCD00834892

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) 6.16 4.16 -12.56 0 3 0 43 388.85 7

Vendor Notes

Note Type Comments Provided By
melting_point 146 - 148 KeyOrganics

Activity (Go SEA)

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