UCSF

ZINC32789151

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2009 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.71 9.45 -50.58 0 5 -1 71 361.45 6
Mid Mid (pH 6-8) 3.71 9.89 -23.39 1 5 0 69 362.458 6

Activity (Go SEA)

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