UCSF

ZINC00632474

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 27 Yes

Other Names:

MFCD00809868

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) 1.32 -5.09 -15.27 3 9 0 114 393.831 7
Mid Mid (pH 6-8) 1.32 -4.85 -44.65 4 9 1 115 394.839 7

Activity (Go SEA)

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