In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 16 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-N-methyl-2-[methyl-[(1S)-1-methylpropyl]amino]acetamide 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) | 0.09 | 4.97 | -40.76 | 3 | 4 | 1 | 51 | 246.4 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.09 | 3.11 | -13.21 | 2 | 4 | 0 | 50 | 245.392 | 7 | ↓ |