UCSF

ZINC40572017

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2010 9 Yes

Other Names:

MFCD12197399

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) -0.04 0.09 -4.89 0 3 0 36 126.159 0

Vendor Notes

Note Type Comments Provided By
MP 44-47° Oakwood Chemical

Activity (Go SEA)

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