UCSF

ZINC05690447

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 27 No

Other Names:

MFCD01555089

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) 4.00 2.51 -60.24 2 5 1 99 378.887 3
Mid Mid (pH 6-8) 4.00 2.34 -117.24 3 5 2 101 379.895 3

Activity (Go SEA)

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