UCSF

ZINC01402760

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 19 Yes

Other Names:

MFCD02082425

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) 2.79 0.77 -9.99 0 4 0 48 277.345 4

Vendor Notes

Note Type Comments Provided By
melting_point 133 - 135 KeyOrganics

Activity (Go SEA)

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