UCSF

ZINC05013479

Substance Information

In ZINC since Heavy atoms Benign functionality
January 16th, 2006 26 No

Other Names:

MFCD02048181

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) 2.41 8.65 -46.21 2 5 1 62 351.426 6
Mid Mid (pH 6-8) 1.82 9.35 -55 1 5 1 59 351.426 6

Activity (Go SEA)

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