UCSF

ZINC32124792

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 26 No

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) 5.38 11.61 -7.65 0 4 0 47 363.486 3
Ref Reference (pH 7) 5.38 10.79 -8.3 0 4 0 47 363.486 3

Activity (Go SEA)

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