UCSF

ZINC02178153

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 16 Yes

Other Names:

MFCD05881860

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) 1.37 2.53 -38.78 3 3 1 40 221.324 5

Activity (Go SEA)

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