UCSF

ZINC10488611

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 26 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) 3.90 2.12 -10.2 0 6 0 62 354.454 6
Mid Mid (pH 6-8) 3.90 2.4 -46.14 1 6 1 63 355.462 6

Activity (Go SEA)

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