UCSF

ZINC02731375

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 26 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 7.16 -54.31 2 6 1 71 374.486 5
Hi High (pH 8-9.5) 2.76 4.93 -17.17 1 6 0 70 373.478 5

Activity (Go SEA)

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