UCSF

ZINC14256634

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2008 23 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) 4.16 7.18 -11.09 1 5 0 72 333.409 7
Mid Mid (pH 6-8) 4.16 7.31 -46.13 0 5 -1 75 332.401 7

Activity (Go SEA)

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