UCSF

ZINC04578423

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2005 26 Yes

Other Names:

MFCD01017452

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) 7.49 3.29 -4.73 0 2 0 26 356.55 8

Activity (Go SEA)

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