UCSF

ZINC02029083

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 17 No

Other Names:

MFCD03237255

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) 1.07 0.25 -12.88 0 6 0 61 301.144 3
Mid Mid (pH 6-8) 1.07 0.51 -51.11 1 6 1 63 302.152 3

Activity (Go SEA)

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