In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (3S,4S)-N3-cyclohexyl-N3-methyl-chromane-3,4-diamine (3S,4S)-N3-cyclohexyl-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) | 1.22 | 4.62 | -41.25 | 3 | 3 | 1 | 40 | 261.389 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.22 | 4.35 | -3.21 | 2 | 3 | 0 | 38 | 260.381 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.22 | 6.22 | -35.89 | 3 | 3 | 1 | 40 | 261.389 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.22 | 6.54 | -128.27 | 4 | 3 | 2 | 41 | 262.397 | 2 | ↓ |