UCSF

ZINC02597785

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2004 30 No

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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) 4.99 8.52 -134.74 0 6 -2 93 460.342 5
Mid Mid (pH 6-8) 4.92 9.59 -49.63 1 6 -1 87 461.35 5

Activity (Go SEA)

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