UCSF

ZINC35864646

Substance Information

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

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.81 8.3 -17.59 0 8 0 72 485.556 9
Mid Mid (pH 6-8) 1.81 10.54 -59.99 1 8 1 73 486.564 9

Activity (Go SEA)

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