UCSF

ZINC37593694

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2009 14 Yes

Other Names:

MFCD11977216

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) 0.96 1.05 -9.46 3 5 0 81 191.19 2
Mid Mid (pH 6-8) 0.96 1.49 -33.9 4 5 1 82 192.198 2

Activity (Go SEA)

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