UCSF

ZINC06614642

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 26 No

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Annotations

Vendors

    None

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) 4.23 13.63 -14.51 1 3 0 28 381.932 7
Lo Low (pH 4.5-6) 4.23 14.1 -50.86 2 3 1 29 382.94 7

Activity (Go SEA)

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