UCSF

ZINC35454571

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 37 No

Popular Name: (2R,3R,4S)-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-2-[(2R,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethy (2R,3R,4S)-4-(9H-pyrido[3,4-b]in…

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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) 1.02 1.95 -55.19 6 11 0 179 512.515 7 ↓
Hi High (pH 8-9.5) 1.02 1.17 -55.22 5 11 -1 177 511.507 7 ↓
Lo Low (pH 4.5-6) 1.02 0.08 -39.72 7 11 1 176 513.523 7 ↓

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