UCSF

ZINC05583892

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2006 24 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) 4.38 10.13 -8.72 1 6 0 78 392.253 6
Mid Mid (pH 6-8) 4.38 10.23 -58.15 2 6 0 79 393.261 6

Activity (Go SEA)

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