UCSF

ZINC00726125

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 28 No

Other Names:

MFCD04147485

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) 1.95 -0.38 -11.04 3 10 0 145 385.38 6
Mid Mid (pH 6-8) 1.95 -0.06 -48.88 4 10 1 146 386.388 6

Activity (Go SEA)

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