UCSF

ZINC36175811

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 21 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) 2.09 7.29 -11.52 1 5 0 48 284.363 4
Lo Low (pH 4.5-6) 2.09 7.79 -38.11 2 5 1 50 285.371 4

Activity (Go SEA)

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