In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (3R,4S)-N3-cyclopropyl-N3-methyl-chromane-3,4-diamine (3R,4S)-N3-cyclopropyl-N3-methyl…
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) | -0.32 | 2.44 | -42.84 | 3 | 3 | 1 | 40 | 219.308 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.32 | 2.14 | -3.46 | 2 | 3 | 0 | 38 | 218.3 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.32 | 4.48 | -35.51 | 3 | 3 | 1 | 40 | 219.308 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.32 | 4.79 | -123.05 | 4 | 3 | 2 | 41 | 220.316 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.