| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 15 | Yes |
Popular Name: N-[[(3S)-1-methylpyrrolidin-3-yl]methyl]-1-(1-methyltriazol-4-yl)methanamine N-[[(3S)-1-methylpyrrolidin-3-yl…
| 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) | 0.18 | 2.74 | -42.64 | 2 | 5 | 1 | 47 | 210.305 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 4.12 | -106.99 | 3 | 5 | 2 | 52 | 211.313 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.18 | 1.5 | -46.28 | 2 | 5 | 1 | 51 | 210.305 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
