UCSF

ZINC35655375

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 20 Yes

Other Names:

MFCD08445899

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) 4.46 9.28 -9.35 2 3 0 44 304.18 2
Lo Low (pH 4.5-6) 4.46 9.01 -53.82 3 3 1 45 305.188 2

Activity (Go SEA)

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