UCSF

ZINC34686087

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 37 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) 0.91 5.69 -18.15 0 10 0 90 513.591 8
Lo Low (pH 4.5-6) 0.91 7.95 -58.31 1 10 1 91 514.599 8

Activity (Go SEA)

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