UCSF

ZINC01714935

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 13 No

Other Names:

MFCD02186882

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) 1.83 4.9 -10.33 1 2 0 29 197.665 4

Vendor Notes

Note Type Comments Provided By
melting_point 81 - 84 KeyOrganics

Activity (Go SEA)

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