UCSF

ZINC04887882

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2006 28 Yes

Other Names:

MFCD01149729

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) 4.00 -2.18 -41.49 3 5 1 48 399.584 6

Activity (Go SEA)

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