UCSF

ZINC08913991

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 25 Yes

Other Names:

MFCD01044096

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) 5.85 10.73 -16.49 1 4 0 55 371.893 4
Mid Mid (pH 6-8) 5.92 9.82 -43.59 0 4 -1 61 370.885 4

Activity (Go SEA)

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