UCSF

ZINC08695204

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2007 36 No

Other Names:

MFCD06239847

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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 13.84 -47.96 2 6 1 71 493.668 15
Mid Mid (pH 6-8) 5.40 14.54 -56.49 1 6 1 68 493.668 15

Activity (Go SEA)

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