UCSF

ZINC00343399

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Other Names:

MFCD05738894

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) -2.75 0.28 -32.32 1 3 1 32 184.222 0
Lo Low (pH 4.5-6) -2.75 0.38 -83.38 2 3 2 33 185.23 0

Activity (Go SEA)

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