UCSF

ZINC26422974

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 17 Yes

Other Names:

MFCD11986806

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) 2.61 7.19 -55.15 2 2 1 22 235.257 1
Mid Mid (pH 6-8) 2.61 5.81 -6.75 1 2 0 17 234.249 1

Activity (Go SEA)

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