UCSF

ZINC32499625

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 29 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) 3.02 8.35 -23.68 1 6 0 62 395.503 7
Mid Mid (pH 6-8) 3.02 10.64 -63.6 2 6 1 63 396.511 7

Activity (Go SEA)

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