UCSF

ZINC02492195

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 30 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) 4.67 9.35 -19.63 1 5 0 72 410.558 8
Hi High (pH 8-9.5) 5.26 9.19 -53.71 1 5 -1 78 409.55 7

Activity (Go SEA)

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