In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-N-methyl-3-[methyl-[2-(2-pyridyl)ethyl]amino]propanamide N-(3-amino-3-thioxo-propyl)-N-me…
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) | -0.22 | 6.47 | -51.79 | 3 | 5 | 1 | 64 | 309.459 | 9 | ↓ |
Hi High (pH 8-9.5) | -0.22 | 4.15 | -16.97 | 2 | 5 | 0 | 62 | 308.451 | 9 | ↓ |