UCSF

ZINC34890860

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 28 No

Other Names:

MFCD01251545

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) 3.22 5.64 -58.19 0 6 -1 76 398.508 6
Mid Mid (pH 6-8) 3.22 7.88 -68.04 1 6 0 77 399.516 6

Activity (Go SEA)

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