UCSF

ZINC14092724

Substance Information

In ZINC since Heavy atoms Benign functionality
July 2nd, 2008 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) 2.86 6.8 -18.98 1 6 0 81 370.217 3
Hi High (pH 8-9.5) 3.05 5.73 -45.14 0 6 -1 87 369.209 3

Activity (Go SEA)

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