In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 15 | Yes |
Popular Name: (3S,4S)-N3-(cyclopropylmethyl)-N4-ethyl-N3-methyl-tetrahydropyran-3,4-diamine (3S,4S)-N3-(cyclopropylmethyl)-N…
None
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) | 1.46 | 5.97 | -109.8 | 3 | 3 | 2 | 30 | 214.353 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 4.05 | -33.37 | 2 | 3 | 1 | 29 | 213.345 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 2.53 | -1.33 | 1 | 3 | 0 | 24 | 212.337 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 4.94 | -29.93 | 2 | 3 | 1 | 26 | 213.345 | 5 | ↓ |