UCSF

ZINC38609850

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 33 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) 4.55 10.32 -17.11 2 8 0 115 440.459 5
Mid Mid (pH 6-8) 4.55 11.09 -54.48 1 8 -1 118 439.451 5

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