UCSF

ZINC32109678

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 27 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) 4.88 11.83 -21.27 2 5 0 67 443.377 7
Hi High (pH 8-9.5) 4.92 11.83 -21.27 2 5 0 69 443.377 6

Activity (Go SEA)

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