UCSF

ZINC20386922

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 21 No

Other Names:

MFCD07021465

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) 0.75 4.42 -11.02 0 7 0 79 291.307 4

Vendor Notes

Note Type Comments Provided By
melting_point 145 - 147 KeyOrganics

Activity (Go SEA)

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