UCSF

ZINC39355689

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2010 36 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) 4.73 11.85 -96.53 3 6 2 74 504.03 6
Hi High (pH 8-9.5) 4.73 9.84 -30.43 2 6 1 73 503.022 6

Activity (Go SEA)

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