UCSF

ZINC58649826

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2011 27 Yes

Other Names:

HPGDS-inhibitor-1

N/A

Download: MOL2 SDF SMILES Flexibase

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) 3.27 9.13 -49.53 2 4 1 46 382.381 5
Mid Mid (pH 6-8) 3.27 7.03 -10.69 1 4 0 45 381.373 5

Activity (Go SEA)

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