UCSF

ZINC31500768

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2009 33 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 2.26 3.18 -18.72 4 9 0 134 464.455 3
Hi High (pH 8-9.5) 2.26 3.71 -53.97 4 9 -1 134 463.447 3

Activity (Go SEA)

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