UCSF

ZINC02488414

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 28 Yes

Other Names:

MFCD03234381

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) 3.91 -3.65 -13.49 3 5 0 80 406.536 5
Lo Low (pH 4.5-6) 3.91 -3.53 -39.33 4 5 1 82 407.544 5

Activity (Go SEA)

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