UCSF

ZINC03908586

Substance Information

In ZINC since Heavy atoms Benign functionality
October 17th, 2005 25 Yes

Other Names:

MFCD03848598

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) 3.94 3.59 -23.58 0 4 0 48 344.292 3

Vendor Notes

Note Type Comments Provided By
melting_point 199 - 201 KeyOrganics

Activity (Go SEA)

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