In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 18 | Yes |
Popular Name: (3R,4S)-N3-(cyclobutylmethyl)-N3-methyl-chromane-3,4-diamine (3R,4S)-N3-(cyclobutylmethyl)-N3…
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) | 0.36 | 3.85 | -43.23 | 3 | 3 | 1 | 40 | 247.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 5.77 | -38.26 | 3 | 3 | 1 | 40 | 247.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 3.55 | -3.34 | 2 | 3 | 0 | 38 | 246.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.