In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 18 | Yes |
Popular Name: (1R,3S)-N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-3-methoxy-cyclohexanamine (1R,3S)-N-(5,6-dihydro-4H-cyclop…
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) | 3.19 | 7.79 | -40.56 | 2 | 2 | 1 | 26 | 266.43 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 6.61 | -4 | 1 | 2 | 0 | 21 | 265.422 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.