UCSF

ZINC32881967

Substance Information

In ZINC since Heavy atoms Benign functionality
May 11th, 2009 28 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) -1.10 1.76 -26.43 3 9 0 117 388.424 5
Hi High (pH 8-9.5) -0.92 -0.03 -53.89 2 9 -1 123 387.416 5

Activity (Go SEA)

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