In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | No |
Popular Name: 2-[(3-carbamothioyl-5,6,7,8-tetrahydroquinolin-2-yl)-methyl-amino]-N-methyl-acetamide 2-[(3-carbamothioyl-5,6,7,8-tetr…
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) | 1.89 | 4.95 | -16.61 | 3 | 5 | 0 | 71 | 292.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 5.48 | -31.01 | 4 | 5 | 1 | 72 | 293.416 | 4 | ↓ |