UCSF

ZINC00703126

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 34 No

Other Names:

MFCD04147979

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) 5.90 -1.2 -16.46 1 6 0 83 486.574 4
Mid Mid (pH 6-8) 5.31 -1.39 -19.76 0 6 0 80 486.574 4

Activity (Go SEA)

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