UCSF

ZINC36392843

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2009 20 No

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 7.24 -34.4 2 5 1 60 283.392 5
Mid Mid (pH 6-8) 2.61 5.26 -11 1 5 0 59 282.384 5

Activity (Go SEA)

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