UCSF

ZINC36181552

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 18 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.80 0.28 -11.95 1 6 0 74 275.326 7
Hi High (pH 8-9.5) 0.80 0.44 -41.46 0 6 -1 76 274.318 7

Activity (Go SEA)

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