UCSF

ZINC39299420

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 13 Yes

Other Names:

MFCD15146208

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) 0.50 0.91 -47.64 4 3 1 61 178.211 2
Hi High (pH 8-9.5) 0.50 0.53 -5.65 3 3 0 59 177.203 2

Activity (Go SEA)

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