UCSF

ZINC32009549

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 13 Yes

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) -1.58 2.51 -62.93 3 5 1 71 198.275 2
Hi High (pH 8-9.5) -1.58 2.18 -11.12 2 5 0 69 197.267 2

Activity (Go SEA)

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