In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 17 | Yes |
Popular Name: (2S)-N2-(cyclopropylmethyl)-N2-isopropyl-2,5-dimethyl-hexane-1,2-diamine (2S)-N2-(cyclopropylmethyl)-N2-i…
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) | 3.05 | 5.6 | -41.26 | 3 | 2 | 1 | 31 | 241.443 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 7.01 | -26.78 | 3 | 2 | 1 | 30 | 241.443 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 7.37 | -114.36 | 4 | 2 | 2 | 32 | 242.451 | 8 | ↓ |