UCSF

ZINC05140312

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 10 Yes

Other Names:

MFCD18254680

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) 1.50 1.99 -5.25 1 2 0 33 137.182 1
Lo Low (pH 4.5-6) 1.50 2.26 -27.1 2 2 1 34 138.19 1

Activity (Go SEA)

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