UCSF

ZINC36886200

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 19 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) -1.30 6.89 -31.13 1 6 0 82 266.297 6
Hi High (pH 8-9.5) -1.30 4.68 -40.63 0 6 -1 81 265.289 6

Activity (Go SEA)

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