In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 16 | Yes |
Popular Name: (3S)-3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pentanamidine (3S)-3-(6,7-dihydro-4H-thieno[3,…
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) | 1.83 | 5.2 | -106.5 | 5 | 3 | 2 | 56 | 239.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 3.25 | -34.11 | 4 | 3 | 1 | 55 | 238.38 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.08 | 5.75 | -28.64 | 5 | 3 | 1 | 56 | 238.38 | 4 | ↓ |