UCSF

ZINC32268845

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2009 29 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) 1.57 6.34 -23.55 1 8 0 90 398.463 6
Mid Mid (pH 6-8) 1.57 8.37 -58.5 2 8 1 91 399.471 6

Activity (Go SEA)

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