UCSF

ZINC00967120

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2004 21 No

CAS Number: 82159-09-9

Other Names:

epalrestat

EPALRESTATE

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) 2.44 -0.42 -54.06 0 4 -1 62 318.399 4

Activity (Go SEA)

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