UCSF

ZINC06492912

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2006 25 No

Other Names:

MFCD02158239

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) 3.14 9.25 -58.13 0 4 -1 60 336.342 5
Mid Mid (pH 6-8) 3.58 1.42 -16.19 1 4 0 57 337.35 4

Activity (Go SEA)

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