UCSF

ZINC41513358

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 28 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) 4.09 9.69 -43.13 2 5 1 64 380.464 5
Mid Mid (pH 6-8) 4.09 10.46 -30.58 1 5 0 67 379.456 5

Activity (Go SEA)

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