UCSF

ZINC32087278

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 23 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) -0.19 6.83 -75.13 2 6 0 91 326.437 6
Mid Mid (pH 6-8) -0.19 5.42 -57.04 1 6 -1 90 325.429 6

Activity (Go SEA)

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