In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 17th, 2006 | 30 | No |
Popular Name: 2-hydroxyethyl-imino-methyl-oxo-N-(3-pyridylmethyl)BLAHcarboxamide 2-hydroxyethyl-imino-methyl-oxo-…
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) | -3.33 | 5.62 | -31.42 | 4 | 9 | 1 | 127 | 405.438 | 5 | ↓ |
Lo Low (pH 4.5-6) | -3.33 | 6.06 | -78.55 | 5 | 9 | 2 | 128 | 406.446 | 5 | ↓ |