UCSF

ZINC35980680

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2009 32 No

Other Names:

MFCD03508418

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) 0.42 7.46 -36.96 1 7 1 66 473.644 8
Mid Mid (pH 6-8) 0.42 9.7 -113.17 2 7 2 67 474.652 8

Activity (Go SEA)

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