UCSF

ZINC15352694

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2008 29 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) 4.39 9.57 -15.11 1 5 0 65 390.435 8
Hi High (pH 8-9.5) 4.39 10.5 -51.72 0 5 -1 68 389.427 8

Activity (Go SEA)

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