UCSF

ZINC01383245

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2005 23 No

Other Names:

MFCD01935845

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.82 7.41 -24.08 0 6 0 63 349.437 2

Vendor Notes

Note Type Comments Provided By
melting_point 244 - 245 KeyOrganics

Activity (Go SEA)

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