In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | No |
Popular Name: 6-methyl-2-[3-[(2R)-2-methyl-1-piperidyl]propylamino]pyridine-3-carbothioamide 6-methyl-2-[3-[(2R)-2-methyl-1-p…
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) | 2.24 | 7.78 | -42.3 | 4 | 4 | 1 | 55 | 307.487 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 8.11 | -95.01 | 5 | 4 | 2 | 57 | 308.495 | 6 | ↓ |