UCSF

ZINC06137009

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2006 35 No

Other Names:

MFCD00771558

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) 6.95 0.49 -8.13 0 5 0 64 471.597 6
Mid Mid (pH 6-8) 7.14 0.55 -9.28 0 5 0 64 471.597 6

Activity (Go SEA)

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