UCSF

ZINC08701065

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 11 Yes

Other Names:

MFCD06637495

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) 2.75 5.79 -3.13 0 1 0 13 149.237 2
Mid Mid (pH 6-8) 2.75 6.24 -30.67 1 1 1 14 150.245 2

Activity (Go SEA)

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