In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 18 | Yes |
Popular Name: [4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-5-methyl-2-furyl]methanamine [4-(6,7-dihydro-4H-thieno[3,2-c]…
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) | 1.60 | 4.43 | -46 | 3 | 3 | 1 | 44 | 263.386 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 6.61 | -101.86 | 4 | 3 | 2 | 45 | 264.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.