UCSF

ZINC01383159

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 25 No

Other Names:

MFCD00975775

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) 5.86 11.43 -9.33 0 3 0 34 367.235 2
Ref Reference (pH 7) 5.86 11.63 -8.3 0 3 0 34 367.235 2

Vendor Notes

Note Type Comments Provided By
melting_point 209 - 211 KeyOrganics

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.