UCSF

ZINC00183007

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 No

Other Names:

MFCD00577517

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) 0.58 3.52 -9.03 1 7 0 101 247.21 4
Lo Low (pH 4.5-6) 0.58 3.79 -40.31 2 7 1 102 248.218 4

Activity (Go SEA)

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