UCSF

ZINC01234269

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2004 23 No

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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) 4.53 6.18 -11.99 2 5 0 74 457.509 2
Mid Mid (pH 6-8) 4.99 4.57 -35.97 1 5 -1 77 456.501 2
Mid Mid (pH 6-8) 4.99 4.26 -45.77 1 5 -1 77 456.501 2

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