In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2007 | 21 | Yes |
Popular Name: 9-amino-N-(o-tolylmethyl)-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraene-8-carboxamide 9-amino-N-(o-tolylmethyl)-7-thia…
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) | 2.65 | 5.11 | -9.85 | 3 | 4 | 0 | 68 | 297.383 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 5.55 | -38.99 | 4 | 4 | 1 | 69 | 298.391 | 3 | ↓ |