UCSF

ZINC09270774

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 32 No

Other Names:

MFCD02160366

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) 3.72 9.22 -49.08 2 7 1 81 439.532 9
Mid Mid (pH 6-8) 2.69 1.29 -47.44 1 7 1 77 439.532 10

Activity (Go SEA)

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