UCSF

ZINC00132848

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Other Names:

MFCD00825044

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) 2.03 4.06 -32.98 4 4 1 69 262.358 2
Mid Mid (pH 6-8) 2.03 3.67 -9.58 3 4 0 68 261.35 2

Activity (Go SEA)

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