UCSF

ZINC04744810

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 17 Yes

Other Names:

MFCD00450856

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) 1.23 3.4 -40.67 2 4 1 43 238.307 5

Vendor Notes

Note Type Comments Provided By
melting_point 67 - 69 KeyOrganics

Activity (Go SEA)

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