UCSF

ZINC35892963

Substance Information

In ZINC since Heavy atoms Benign functionality
October 14th, 2009 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 6.58 16.24 -6.9 0 4 0 32 482.697 6
Mid Mid (pH 6-8) 6.58 18.46 -46.87 1 4 1 33 483.705 6

Activity (Go SEA)

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