UCSF

ZINC06786467

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 30 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.95 6.18 -63.04 2 8 -1 127 410.402 7
Mid Mid (pH 6-8) 0.92 7.03 -60.75 1 8 -1 124 410.402 8

Activity (Go SEA)

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