In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 16 | No |
Popular Name: 3-amino-N-[2-(diisopropylamino)ethyl]-3-thioxo-propanamide 3-amino-N-[2-(diisopropylamino)e…
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) | -0.02 | 3.12 | -48.94 | 4 | 4 | 1 | 60 | 246.4 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.02 | 1.05 | -21.66 | 3 | 4 | 0 | 58 | 245.392 | 7 | ↓ |