UCSF

ZINC08384198

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 36 No

Other Names:

MFCD04148040

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) 4.44 -0.16 -52.65 2 7 1 80 493.624 11
Mid Mid (pH 6-8) 3.86 -0.32 -60.68 1 7 1 77 493.624 11

Activity (Go SEA)

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