UCSF

ZINC36532649

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2009 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) -1.07 -4.47 -10.13 3 7 0 105 307.1 2
Hi High (pH 8-9.5) -0.61 -7.18 -47.14 2 7 -1 108 306.092 2

Activity (Go SEA)

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