UCSF

ZINC08383811

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 33 No

Other Names:

MFCD04448736

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) 1.76 -1.68 -56.98 2 8 1 89 451.499 6
Mid Mid (pH 6-8) 1.18 -1.84 -66.62 1 8 1 86 451.499 6

Activity (Go SEA)

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