UCSF

ZINC05491442

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 29 No

Other Names:

MFCD02229729

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) 2.70 -0.56 -46.92 2 6 1 71 393.463 5
Mid Mid (pH 6-8) 1.67 -0.74 -49 1 6 1 68 393.463 6

Activity (Go SEA)

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