UCSF

ZINC09374556

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 29 No

Other Names:

MFCD02048202

Download: MOL2 SDF SMILES Flexibase

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) 3.29 9.69 -48.1 2 6 1 71 395.479 7
Mid Mid (pH 6-8) 2.26 1.13 -47.59 1 6 1 68 395.479 8

Activity (Go SEA)

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