UCSF

ZINC39869934

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 26 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) 4.09 9.24 -203.55 0 8 -3 137 434.203 5
Mid Mid (pH 6-8) 4.09 9.73 -132.08 1 8 -2 135 435.211 5

Activity (Go SEA)

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