UCSF

ZINC04887558

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2006 22 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) 2.14 -2.17 -16.78 5 7 0 131 302.238 1
Hi High (pH 8-9.5) 2.14 -1.13 -47.35 4 7 -1 134 301.23 1

Activity (Go SEA)

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