UCSF

ZINC32263058

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2009 25 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) 3.32 9.51 -36.39 0 5 -1 61 360.503 7
Mid Mid (pH 6-8) 2.86 10.5 -10.78 1 5 0 58 361.511 7

Activity (Go SEA)

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