UCSF

ZINC64806135

Substance Information

In ZINC since Heavy atoms Benign functionality
June 26th, 2011 24 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) 2.46 5.95 -44.11 3 6 1 72 336.456 10
Hi High (pH 8-9.5) 2.46 4.32 -18.56 2 6 0 71 335.448 10

Activity (Go SEA)

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