UCSF

ZINC24116518

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2009 38 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) 2.98 7.79 -58.87 0 9 -1 101 521.59 11
Mid Mid (pH 6-8) 2.98 10.13 -75.16 1 9 0 102 522.598 11

Activity (Go SEA)

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