UCSF

ZINC05901573

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 13 Yes

Other Names:

CA-5550

MFCD03032627

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) -0.12 2.41 -47.23 0 3 -1 63 174.179 3

Activity (Go SEA)

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