UCSF

ZINC06350087

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 29 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) 4.13 11.71 -17.96 0 6 0 63 415.559 8
Mid Mid (pH 6-8) 4.13 11.81 -48.76 1 6 0 64 416.567 8

Activity (Go SEA)

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