UCSF

ZINC04655064

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2005 21 No

CAS Numbers: 1156-92-9 , 1852-61-5

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) 3.43 -3.02 -3.79 2 2 0 40 290.447 0

Activity (Go SEA)

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