UCSF

ZINC36886197

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 17 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) -1.66 5.45 -33.61 1 6 0 82 240.259 5
Hi High (pH 8-9.5) -1.66 3.11 -41.12 0 6 -1 81 239.251 5

Activity (Go SEA)

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