UCSF

ZINC08434862

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 26 No

Other Names:

MFCD00612610

Download: MOL2 SDF SMILES Flexibase

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) 3.84 -2.65 -6.81 1 7 0 75 361.49 8
Mid Mid (pH 6-8) 3.84 -2.41 -34.2 2 7 1 77 362.498 8

Activity (Go SEA)

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