UCSF

ZINC39870057

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 26 No

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) 4.47 9.02 -76.59 1 6 -1 91 367.406 5
Mid Mid (pH 6-8) 4.47 8.36 -130.03 0 6 -2 93 366.398 5

Activity (Go SEA)

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