In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 12 | Yes |
Popular Name: (3S)-N-(cyclobutylmethyl)-N-methyl-pyrrolidin-3-amine (3S)-N-(cyclobutylmethyl)-N-meth…
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) | 1.29 | 3.21 | -36.22 | 2 | 2 | 1 | 20 | 169.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 1.8 | -1.17 | 1 | 2 | 0 | 15 | 168.284 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 4.05 | -32.05 | 2 | 2 | 1 | 16 | 169.292 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 5.46 | -105.43 | 3 | 2 | 2 | 21 | 170.3 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.