UCSF

ZINC08441765

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 39 No

Other Names:

MFCD04088611

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) 5.99 0.99 -13.43 1 6 0 79 515.565 8
Mid Mid (pH 6-8) 5.41 0.8 -18.83 0 6 0 76 515.565 8

Activity (Go SEA)

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