UCSF

ZINC08951234

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2007 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) 5.81 -1.66 -18.86 2 6 0 68 487.409 4
Hi High (pH 8-9.5) 5.81 -1.47 -50.46 1 6 -1 70 486.401 4

Activity (Go SEA)

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