UCSF

ZINC06155732

Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2006 23 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) 2.02 8.28 -15.55 1 7 0 82 311.345 3
Mid Mid (pH 6-8) 2.19 8.55 -33.92 2 7 1 87 312.353 3

Activity (Go SEA)

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