UCSF

ZINC00203305

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 20 Yes

Other Names:

MFCD00990272

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) 2.77 -1.66 -54.39 2 3 1 36 285.754 1

Vendor Notes

Note Type Comments Provided By
melting_point 166 - 167 KeyOrganics

Activity (Go SEA)

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