UCSF

ZINC08383938

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 36 No

Other Names:

MFCD04148013

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) 3.68 0.22 -50.25 2 8 1 89 495.596 11
Mid Mid (pH 6-8) 3.10 0.11 -59.56 1 8 1 86 495.596 11

Activity (Go SEA)

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