UCSF

ZINC36640515

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 36 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) 6.18 12.78 -38.11 1 7 1 65 506.648 11
Hi High (pH 8-9.5) 6.18 10.66 -12.32 0 7 0 64 505.64 11

Activity (Go SEA)

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