UCSF

ZINC06412373

Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2006 27 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 0.01 3.16 -51.62 5 8 1 123 383.513 9
Hi High (pH 8-9.5) 0.01 3.08 -15.47 4 8 0 122 382.505 9

Activity (Go SEA)

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