In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | No |
Popular Name: 3-[ethyl-[(5-ethyl-2-thienyl)methyl]amino]propanethioamide 3-[ethyl-[(5-ethyl-2-thienyl)met…
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) | 2.00 | 7.65 | -41.97 | 3 | 2 | 1 | 30 | 257.448 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 5.49 | -7.83 | 2 | 2 | 0 | 29 | 256.44 | 7 | ↓ |