UCSF

ZINC17992533

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 32 No

Other Names:

MFCD01798819

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) 4.34 14.22 -10.39 0 6 0 81 431.488 6
Ref Reference (pH 7) 4.34 14.23 -11.58 0 6 0 81 431.488 6

Activity (Go SEA)

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