UCSF

ZINC00724785

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 24 No

Other Names:

MFCD03861652

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) 2.21 -2.57 -10.73 1 5 0 61 355.341 4
Mid Mid (pH 6-8) 2.21 -1.53 -42.83 2 5 1 63 356.349 4

Activity (Go SEA)

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