UCSF

ZINC04899657

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2006 28 Yes

CAS Number: 55478-23-4

Other Names:

MFCD00236965

SS-0761

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) 2.62 7.67 -52.18 2 8 -1 117 385.396 11

Activity (Go SEA)

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