UCSF

ZINC01405930

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 15 Yes

Other Names:

MFCD01315301

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) 2.89 5.38 -5.13 0 3 0 25 226.345 2
Mid Mid (pH 6-8) 2.89 5.78 -24.26 1 3 1 27 227.353 2

Vendor Notes

Note Type Comments Provided By
melting_point Oil KeyOrganics

Activity (Go SEA)

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