In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 18 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]thiophene-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-[[(2S)-…
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) | 0.65 | 2.59 | -56 | 4 | 4 | 1 | 66 | 265.358 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 2.18 | -8.53 | 3 | 4 | 0 | 64 | 264.35 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.