In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | No |
Popular Name: 2-(2-morpholinoethylamino)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-(2-morpholinoethylamino)-6,7-d…
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) | 1.40 | 3.08 | -12.99 | 3 | 5 | 0 | 63 | 306.435 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 3.41 | -38.24 | 4 | 5 | 1 | 65 | 307.443 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 5.34 | -44.72 | 4 | 5 | 1 | 65 | 307.443 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 5.67 | -103.76 | 5 | 5 | 2 | 66 | 308.451 | 5 | ↓ |