UCSF

ZINC34684599

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 31 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) 4.71 10.8 -10.56 1 4 0 36 437.946 6
Mid Mid (pH 6-8) 4.71 13 -48.71 2 4 1 37 438.954 6

Activity (Go SEA)

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