UCSF

ZINC31959250

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 21 Yes

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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) 1.42 3.88 -61.38 4 6 1 92 307.399 6
Hi High (pH 8-9.5) 1.42 3.5 -19.9 3 6 0 90 306.391 6
Hi High (pH 8-9.5) 1.24 2.43 -43.64 2 6 -1 96 305.383 6
Mid Mid (pH 6-8) 1.24 2.81 -46.49 3 6 0 98 306.391 6

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