UCSF

ZINC24928982

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 30 Yes

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) 2.76 9.85 -73.7 2 7 1 76 408.478 6
Mid Mid (pH 6-8) 2.76 7.53 -32.11 1 7 0 75 407.47 6

Activity (Go SEA)

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