UCSF

ZINC36878959

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 18 Yes

Other Names:

MFCD12106426

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) -0.11 5.43 -39.76 2 6 0 86 258.318 5
Hi High (pH 8-9.5) -0.11 4.27 -45.68 1 6 -1 82 257.31 5

Activity (Go SEA)

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