UCSF

ZINC08199059

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 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) 3.76 7.81 -13.14 1 4 0 62 310.328 4
Hi High (pH 8-9.5) 3.95 6.19 -47.62 0 4 -1 68 309.32 4

Activity (Go SEA)

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