UCSF

ZINC12007768

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 33 No

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) 3.56 11.28 -35 2 11 0 152 448.439 6
Mid Mid (pH 6-8) 4.02 10.95 -54.68 1 11 -1 155 447.431 6
Mid Mid (pH 6-8) 3.56 12.38 -17.8 2 11 0 152 448.439 6

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