UCSF

ZINC09286842

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 23 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) 2.66 7.06 -62.59 1 5 1 54 334.465 4
Mid Mid (pH 6-8) 2.66 4.85 -18.06 0 5 0 53 333.457 4

Activity (Go SEA)

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