UCSF

ZINC16679641

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 33 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) 2.02 4 -49.47 2 10 1 127 500.619 10
Hi High (pH 8-9.5) 2.02 3.97 -46.56 1 10 0 130 499.611 10

Activity (Go SEA)

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