UCSF

ZINC02308397

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 26 No

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Annotations

Vendors

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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) 1.69 2.7 -51.97 2 8 -1 116 355.374 4
Mid Mid (pH 6-8) 1.24 5.34 -14.74 3 8 0 113 356.382 4

Activity (Go SEA)

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