In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 21 | No |
Popular Name: 2-[3-(methyl-phenyl-amino)propylamino]pyridine-3-carbothioamide 2-[3-(methyl-phenyl-amino)propyl…
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 | 7.13 | -16.26 | 3 | 4 | 0 | 54 | 300.431 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 7.48 | -49.65 | 4 | 4 | 1 | 55 | 301.439 | 7 | ↓ |