UCSF

ZINC04123661

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2005 25 No

Other Names:

MFCD00741505

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) 2.59 3.18 -60.69 2 5 1 99 334.378 1
Mid Mid (pH 6-8) 2.59 3.01 -116.07 3 5 2 101 335.386 1

Activity (Go SEA)

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