UCSF

ZINC34684814

Substance Information

In ZINC since Heavy atoms Benign functionality
September 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) 3.19 7.64 -12.52 1 6 0 58 405.498 7
Mid Mid (pH 6-8) 3.19 9.86 -48.21 2 6 1 59 406.506 7

Activity (Go SEA)

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