UCSF

ZINC32228375

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 15 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.87 7.94 -39.63 1 2 1 22 204.293 2
Hi High (pH 8-9.5) 1.87 6.04 -4.51 0 2 0 20 203.285 2

Activity (Go SEA)

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