UCSF

ZINC00872142

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 25 Yes

Other Names:

MFCD02107136

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) 2.17 7.6 -47.11 1 6 1 52 351.467 7
Mid Mid (pH 6-8) 2.17 5.93 -9.23 0 6 0 51 350.459 7

Activity (Go SEA)

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