UCSF

ZINC13573414

Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 15 Yes

Other Names:

MFCD01077941

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) 3.55 5.07 -9.67 0 3 0 34 220.297 1
Ref Reference (pH 7) 3.55 5.74 -9.81 0 3 0 34 220.297 1

Activity (Go SEA)

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