UCSF

ZINC00387541

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 21 No

Other Names:

MFCD05741944

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) -0.70 -0.8 -27.85 0 2 1 3 279.407 3
Mid Mid (pH 6-8) -0.70 2.55 -105.82 1 2 2 4 280.415 3

Activity (Go SEA)

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