UCSF

ZINC00480328

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 16 Yes

Other Names:

MFCD04149882

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) 2.31 0.37 -12.48 0 3 0 30 229.308 1
Mid Mid (pH 6-8) 2.31 0.57 -24.87 1 3 1 31 230.316 1

Activity (Go SEA)

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