UCSF

ZINC12007375

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 30 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) 3.36 11.36 -34.21 2 8 0 106 403.442 7
Mid Mid (pH 6-8) 3.82 11.02 -53.63 1 8 -1 109 402.434 7
Mid Mid (pH 6-8) 3.36 12.19 -15.14 2 8 0 106 403.442 7

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