UCSF

ZINC08384308

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 34 No

Other Names:

MFCD04148052

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) 3.51 1.36 -46.66 2 7 1 84 461.538 9
Mid Mid (pH 6-8) 2.93 1.18 -54.3 1 7 1 81 461.538 9

Activity (Go SEA)

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