UCSF

ZINC02080852

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 31 No

Other Names:

MFCD01243726

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) 2.68 -2.64 -33.67 1 5 1 161 446.879 12

Activity (Go SEA)

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