UCSF

ZINC00703123

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 No

Other Names:

MFCD04088582

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) 6.00 -0.02 -16.14 1 6 0 83 480.545 4
Mid Mid (pH 6-8) 5.41 -0.19 -20.26 0 6 0 80 480.545 4

Activity (Go SEA)

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