In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (3R,4S)-N3-(cyclopropylmethyl)-N3,N4-dipropyl-tetrahydropyran-3,4-diamine (3R,4S)-N3-(cyclopropylmethyl)-N…
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) | 2.85 | 7.65 | -113.13 | 3 | 3 | 2 | 30 | 256.434 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.85 | 4.36 | -1.16 | 1 | 3 | 0 | 24 | 254.418 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.85 | 5.91 | -35.39 | 2 | 3 | 1 | 29 | 255.426 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 6.52 | -29.27 | 2 | 3 | 1 | 26 | 255.426 | 8 | ↓ |