UCSF

ZINC06308925

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2006 30 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) 3.33 0.12 -15.44 1 6 0 76 407.466 10
Mid Mid (pH 6-8) 2.75 0.01 -23.8 0 6 0 72 407.466 10

Activity (Go SEA)

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