UCSF

ZINC06344852

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 15 No

Other Names:

MFCD01408697

Download: MOL2 SDF SMILES Flexibase

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) 2.41 6.38 -11.37 0 3 0 33 200.241 1
Ref Reference (pH 7) 2.41 6.38 -11.51 0 3 0 33 200.241 1
Mid Mid (pH 6-8) 2.22 4.37 -9.62 1 3 0 38 200.241 1

Activity (Go SEA)

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