In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | No |
Popular Name: (2R)-2-[(3-carbamothioyl-5,6,7,8-tetrahydroquinolin-2-yl)amino]propanamide (2R)-2-[(3-carbamothioyl-5,6,7,8…
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) | 1.66 | 2.19 | -17.2 | 5 | 5 | 0 | 94 | 278.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 2.5 | -44.45 | 6 | 5 | 1 | 95 | 279.389 | 4 | ↓ |